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Home > Other Heterocycles > 2059993-93-8
2059993-93-8 | 7-methyl-8-(1H-pyrrol-2-yl)-5-oxa-2,7-diazaspiro[3.4]octan-6-one
CAS No: 2059993-93-8 Catalog No: AG01BVYK MDL No:MFCD30476593
Product Description
Catalog Number:
AG01BVYK
Chemical Name:
7-methyl-8-(1H-pyrrol-2-yl)-5-oxa-2,7-diazaspiro[3.4]octan-6-one
CAS Number:
2059993-93-8
Molecular Formula:
C10H13N3O2
Molecular Weight:
207.2291
MDL Number:
MFCD30476593
IUPAC Name:
7-methyl-8-(1H-pyrrol-2-yl)-5-oxa-2,7-diazaspiro[3.4]octan-6-one
InChI:
InChI=1S/C10H13N3O2/c1-13-8(7-3-2-4-12-7)10(5-11-6-10)15-9(13)14/h2-4,8,11-12H,5-6H2,1H3
InChI Key:
FPQHGFXKUFEVJP-UHFFFAOYSA-N
SMILES:
O=C1OC2(C(N1C)c1ccc[nH]1)CNC2
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.233g/mol
Monoisotopic Mass:
207.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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