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Home > Other Heterocycles > 2060029-11-8
2060029-11-8 | 1-[1-(propan-2-yl)-1H-pyrrol-3-yl]-7-oxa-2-azaspiro[3.5]nonane
CAS No: 2060029-11-8 Catalog No: AG01BQGG MDL No:MFCD30501419
Product Description
Catalog Number:
AG01BQGG
Chemical Name:
1-[1-(propan-2-yl)-1H-pyrrol-3-yl]-7-oxa-2-azaspiro[3.5]nonane
CAS Number:
2060029-11-8
Molecular Formula:
C14H22N2O
Molecular Weight:
234.3373
MDL Number:
MFCD30501419
IUPAC Name:
3-(1-propan-2-ylpyrrol-3-yl)-7-oxa-2-azaspiro[3.5]nonane
InChI:
InChI=1S/C14H22N2O/c1-11(2)16-6-3-12(9-16)13-14(10-15-13)4-7-17-8-5-14/h3,6,9,11,13,15H,4-5,7-8,10H2,1-2H3
InChI Key:
UOKXYSYUWQZBOZ-UHFFFAOYSA-N
SMILES:
CC(n1ccc(c1)C1NCC21CCOCC2)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.343g/mol
Monoisotopic Mass:
234.173g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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