1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone

C9H13N3O — CID 141368944

IUPAC1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone
SMILESCC(=O)n1cnc2c1CN(C)CC2
InChIInChI=1S/C9H13N3O/c1-7(13)12-6-10-8-3-4-11(2)5-9(8)12/h6H,3-5H2,1-2H3
InChIKeyMOJZLNCFPYQLOX-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.53
Rot. Bonds

About 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone

1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone (PubChem CID 141368944) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone.

Molecular Properties

Compound Name1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone
PubChem CID141368944
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone
SMILESCC(=O)n1cnc2c1CN(C)CC2
InChIInChI=1S/C9H13N3O/c1-7(13)12-6-10-8-3-4-11(2)5-9(8)12/h6H,3-5H2,1-2H3
InChIKeyMOJZLNCFPYQLOX-UHFFFAOYSA-N
XLogP0.53
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6,7-dihydro-4H-imidazo[4,5-c]pyridine-3,5-dicarboxylic acid
CID 175715833
1-(5-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-1-yl)ethanone
CID 141368938
1-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)propan-2-one
CID 83859099
3-(6-methyl-3-oxo-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-2-yl)propanoic acid
CID 99983365
cyclopropyl-(3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)methanone
CID 110872601
2-ethyl-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carboxylic acid
CID 116532966
6-methyl-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylate
CID 163670046
2-tert-butyl-5-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 105499255
2-(2,5-dimethyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl)acetic acid
CID 83862715
6-methyl-2-propyl-7,8-dihydro-5H-1,6-naphthyridine-3-carboxylic acid
CID 116533203
2-ethyl-6-methyl-7,8-dihydro-5H-pyrido[3,4-b]pyrazine
CID 126630238
1-(1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl)ethanone
CID 129182181

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone?
The IUPAC name of 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone (CID 141368944) is 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone.
What is the SMILES notation for 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone?
The canonical SMILES for 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone is CC(=O)n1cnc2c1CN(C)CC2.
What is the InChIKey of 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone?
The InChIKey is MOJZLNCFPYQLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-7(13)12-6-10-8-3-4-11(2)5-9(8)12/h6H,3-5H2,1-2H3.
What are the key properties of 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone?
1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone has a molecular weight of 179.22 g/mol, XLogP of 0.53, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-3-yl)ethanone is sourced from PubChem (CID 141368944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).