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380605-29-8 | 1-Cyclopropyl-1,3-dihydro-2H-imidazo[4,5-c]pyridin-2-one
CAS No: 380605-29-8 Catalog No: AG003E9F MDL No:MFCD09954763
Product Description
Catalog Number:
AG003E9F
Chemical Name:
1-Cyclopropyl-1,3-dihydro-2H-imidazo[4,5-c]pyridin-2-one
CAS Number:
380605-29-8
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD09954763
IUPAC Name:
1-cyclopropyl-3H-imidazo[4,5-c]pyridin-2-one
InChI:
InChI=1S/C9H9N3O/c13-9-11-7-5-10-4-3-8(7)12(9)6-1-2-6/h3-6H,1-2H2,(H,11,13)
InChI Key:
JTPBTNNOXCHJDL-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c(n1C1CC1)ccnc2
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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