1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide

C19H19ClN4O3 — CID 109066429

IUPAC1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCOc1ccc(NC(=O)c2nc(C(=O)NC(C)C)n3ccccc23)cc1Cl
InChIInChI=1S/C19H19ClN4O3/c1-11(2)21-19(26)17-23-16(14-6-4-5-9-24(14)17)18(25)22-12-7-8-15(27-3)13(20)10-12/h4-11H,1-3H3,(H,21,26)(H,22,25)
InChIKeyPABRENIZFXDBHO-UHFFFAOYSA-N
MW386.84 g/mol
LogP3.39
Rot. Bonds5

About 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide

1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109066429) has the molecular formula C19H19ClN4O3 and a molecular weight of 386.84 g/mol. Its IUPAC name is 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109066429
Molecular FormulaC19H19ClN4O3
Molecular Weight386.84 g/mol
Exact Mass386.11
IUPAC Name1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCOc1ccc(NC(=O)c2nc(C(=O)NC(C)C)n3ccccc23)cc1Cl
InChIInChI=1S/C19H19ClN4O3/c1-11(2)21-19(26)17-23-16(14-6-4-5-9-24(14)17)18(25)22-12-7-8-15(27-3)13(20)10-12/h4-11H,1-3H3,(H,21,26)(H,22,25)
InChIKeyPABRENIZFXDBHO-UHFFFAOYSA-N
XLogP3.39
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.84
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-N-(3-chloro-4-methoxyphenyl)-1-N-prop-2-enylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066906
1-N-(2-methoxy-5-methylphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066436
1-N-(2,5-dichlorophenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066464
ethyl 4-[[3-(propan-2-ylcarbamoyl)imidazo[1,5-a]pyridine-1-carbonyl]amino]benzoate
CID 109066459
3-N-(4-ethylphenyl)-1-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066252
3-N-(3-chloro-2-methylphenyl)-1-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066267
3-N-(4-methoxyphenyl)-1-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067477
1-N-[2-(4-methoxyphenoxy)ethyl]-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066382
3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071776
1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066744
1-N-[2-(3-methoxyphenyl)ethyl]-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066366
N-(3-chloro-4-methoxyphenyl)-4-oxo-3-propan-2-ylphthalazine-1-carboxamide
CID 2713554

Frequently Asked Questions

What is the IUPAC name of 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109066429) is 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide is COc1ccc(NC(=O)c2nc(C(=O)NC(C)C)n3ccccc23)cc1Cl.
What is the InChIKey of 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is PABRENIZFXDBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O3/c1-11(2)21-19(26)17-23-16(14-6-4-5-9-24(14)17)18(25)22-12-7-8-15(27-3)13(20)10-12/h4-11H,1-3H3,(H,21,26)(H,22,25).
What are the key properties of 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 386.84 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3-chloro-4-methoxyphenyl)-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109066429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).