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Home > Other Heterocycles > 2060007-43-2
2060007-43-2 | 3-cyclopropyl-6-(1-methyl-1H-pyrrol-2-yl)-7-oxa-3-azabicyclo[4.1.0]heptane
CAS No: 2060007-43-2 Catalog No: AG01BQD3 MDL No:MFCD30501295
Product Description
Catalog Number:
AG01BQD3
Chemical Name:
3-cyclopropyl-6-(1-methyl-1H-pyrrol-2-yl)-7-oxa-3-azabicyclo[4.1.0]heptane
CAS Number:
2060007-43-2
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
MDL Number:
MFCD30501295
IUPAC Name:
3-cyclopropyl-6-(1-methylpyrrol-2-yl)-7-oxa-3-azabicyclo[4.1.0]heptane
InChI:
InChI=1S/C13H18N2O/c1-14-7-2-3-11(14)13-6-8-15(10-4-5-10)9-12(13)16-13/h2-3,7,10,12H,4-6,8-9H2,1H3
InChI Key:
UGPFQSGQUVHWSB-UHFFFAOYSA-N
SMILES:
Cn1cccc1C12CCN(CC2O1)C1CC1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.3g/mol
Monoisotopic Mass:
218.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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