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380605-23-2 | 3-Cyclopropyl-1H-imidazo[4,5-b]pyridin-2(3H)-one
CAS No: 380605-23-2 Catalog No: AG0076FJ MDL No:MFCD06657770
Product Description
Catalog Number:
AG0076FJ
Chemical Name:
3-Cyclopropyl-1H-imidazo[4,5-b]pyridin-2(3H)-one
CAS Number:
380605-23-2
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD06657770
IUPAC Name:
3-cyclopropyl-1H-imidazo[4,5-b]pyridin-2-one
InChI:
InChI=1S/C9H9N3O/c13-9-11-7-2-1-5-10-8(7)12(9)6-3-4-6/h1-2,5-6H,3-4H2,(H,11,13)
InChI Key:
TYRKIZFEPKKIFU-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c(n1C1CC1)nccc2
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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