2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone

C11H14N4O — CID 84683736

IUPAC2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone
SMILESCC(C)c1nc2ncc(C(=O)CN)cc2[nH]1
InChIInChI=1S/C11H14N4O/c1-6(2)10-14-8-3-7(9(16)4-12)5-13-11(8)15-10/h3,5-6H,4,12H2,1-2H3,(H,13,14,15)
InChIKeyVHAJAVRRQVFSEW-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.22
Rot. Bonds3

About 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone

2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone (PubChem CID 84683736) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone
PubChem CID84683736
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone
SMILESCC(C)c1nc2ncc(C(=O)CN)cc2[nH]1
InChIInChI=1S/C11H14N4O/c1-6(2)10-14-8-3-7(9(16)4-12)5-13-11(8)15-10/h3,5-6H,4,12H2,1-2H3,(H,13,14,15)
InChIKeyVHAJAVRRQVFSEW-UHFFFAOYSA-N
XLogP1.22
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

AR-H047108
CID 9864291
3-(5-Methyl-1H-imidazol-4-yl)-1-(1-methyl-1H-indol-3-yl)-1-propanone
CID 5311136
(E)-2-cyano-3-[4-[[7-(2,2-dimethylpropanoyl)-5H-pyrrolo[2,3-b]pyrazin-2-yl]amino]phenyl]-N,N-dimethylprop-2-enamide
CID 71014325
N-(5-methyl-2-pyridinyl)-3H-benzimidazole-5-carboxamide
CID 24686534
1h-Benzimidazol-2-Yl(1h-Pyrrol-2-Yl)methanone
CID 70689160
4-Benzoyl-N-2-pyridinyl-1H-imidazole-5-carboxamide
CID 604408
1-[1-Methyl-5-(1-methylbenzimidazol-2-yl)pyrrol-3-yl]ethanone
CID 976892
(E)-1-(1H-benzimidazol-2-yl)-3-pyridin-4-ylprop-2-en-1-one
CID 6028063
2-pyridin-4-yl-1H-benzimidazole-4-carboxamide
CID 9905711
phenyl-(2-pyridin-2-yl-1H-benzoimidazol-5-yl)-methanone
CID 11609106
4-[[(1S,2R)-2-methylcyclohexyl]amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 11993785
4-amino-3-(3H-imidazo[4,5-b]pyridin-2-yl)quinolin-2(1H)-one
CID 22664657

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone?
The IUPAC name of 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone (CID 84683736) is 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone.
What is the SMILES notation for 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone?
The canonical SMILES for 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone is CC(C)c1nc2ncc(C(=O)CN)cc2[nH]1.
What is the InChIKey of 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone?
The InChIKey is VHAJAVRRQVFSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-6(2)10-14-8-3-7(9(16)4-12)5-13-11(8)15-10/h3,5-6H,4,12H2,1-2H3,(H,13,14,15).
What are the key properties of 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone?
2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone has a molecular weight of 218.26 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-propan-2-yl-1H-imidazo[4,5-b]pyridin-6-yl)ethanone is sourced from PubChem (CID 84683736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).