2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C18H23N3O2 — CID 129347202

IUPAC2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC[C@H](NC(=O)c1c2n(c(=O)n1C)CCCC2)c1ccccc1
InChIInChI=1S/C18H23N3O2/c1-3-14(13-9-5-4-6-10-13)19-17(22)16-15-11-7-8-12-21(15)18(23)20(16)2/h4-6,9-10,14H,3,7-8,11-12H2,1-2H3,(H,19,22)/t14-/m0/s1
InChIKeyUOBDRQHUZSZESH-AWEZNQCLSA-N
MW313.40 g/mol
LogP2.40
Rot. Bonds4

About 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 129347202) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID129347202
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC[C@H](NC(=O)c1c2n(c(=O)n1C)CCCC2)c1ccccc1
InChIInChI=1S/C18H23N3O2/c1-3-14(13-9-5-4-6-10-13)19-17(22)16-15-11-7-8-12-21(15)18(23)20(16)2/h4-6,9-10,14H,3,7-8,11-12H2,1-2H3,(H,19,22)/t14-/m0/s1
InChIKeyUOBDRQHUZSZESH-AWEZNQCLSA-N
XLogP2.40
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide with MolForge

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Related Compounds

3-N-benzyl-1-N-(1-phenylpropyl)-5,6,7,8-tetrahydroindolizine-1,3-dicarboxamide
CID 123457893
3-N-[2-(4-fluorophenyl)ethyl]-1-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroindolizine-1,3-dicarboxamide
CID 71696132
3-N-[2-(4-fluorophenyl)ethyl]-1-N-(1-phenylpropyl)-5,6,7,8-tetrahydroindolizine-1,3-dicarboxamide
CID 78151822
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
1-methyl-N-(1-phenylpropyl)piperidine-4-carboxamide
CID 50875269
N-[(1S)-1-phenylpropyl]-4-(piperidin-1-ylsulfonylmethyl)benzamide
CID 28569285
N-(1-phenylpropyl)-4-(piperidin-1-ylsulfonylmethyl)benzamide
CID 43875835
1-cyclohexyl-N-[(1R)-1-phenylpropyl]-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 59836372
methyl (3S)-3-[(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbonyl)amino]-3-phenylpropanoate
CID 97008528
N-[1-(4-hydroxyphenyl)propan-2-yl]-N,2-dimethyl-3-oxo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 154759969
(3R)-1-methyl-N-[(1S)-1-phenylpropyl]piperidine-3-carboxamide
CID 99970401
4-(3,4-dihydro-2H-quinolin-1-ylmethyl)-N-[(1R)-1-phenylpropyl]benzamide
CID 30400404

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 129347202) is 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is CC[C@H](NC(=O)c1c2n(c(=O)n1C)CCCC2)c1ccccc1.
What is the InChIKey of 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is UOBDRQHUZSZESH-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-3-14(13-9-5-4-6-10-13)19-17(22)16-15-11-7-8-12-21(15)18(23)20(16)2/h4-6,9-10,14H,3,7-8,11-12H2,1-2H3,(H,19,22)/t14-/m0/s1.
What are the key properties of 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-oxo-N-[(1S)-1-phenylpropyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 129347202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).