1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide

C18H14ClFN4O2 — CID 109066744

IUPAC1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1nc(C(=O)NC2CC2)n2ccccc12
InChIInChI=1S/C18H14ClFN4O2/c19-12-9-11(6-7-13(12)20)22-17(25)15-14-3-1-2-8-24(14)16(23-15)18(26)21-10-4-5-10/h1-3,6-10H,4-5H2,(H,21,26)(H,22,25)
InChIKeyBIEQGQXBVMMXIG-UHFFFAOYSA-N
MW372.79 g/mol
LogP3.27
Rot. Bonds4

About 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide

1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109066744) has the molecular formula C18H14ClFN4O2 and a molecular weight of 372.79 g/mol. Its IUPAC name is 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109066744
Molecular FormulaC18H14ClFN4O2
Molecular Weight372.79 g/mol
Exact Mass372.08
IUPAC Name1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESO=C(Nc1ccc(F)c(Cl)c1)c1nc(C(=O)NC2CC2)n2ccccc12
InChIInChI=1S/C18H14ClFN4O2/c19-12-9-11(6-7-13(12)20)22-17(25)15-14-3-1-2-8-24(14)16(23-15)18(26)21-10-4-5-10/h1-3,6-10H,4-5H2,(H,21,26)(H,22,25)
InChIKeyBIEQGQXBVMMXIG-UHFFFAOYSA-N
XLogP3.27
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.79
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[3-(cyclopropylcarbamoyl)imidazo[1,5-a]pyridine-1-carbonyl]amino]benzoate
CID 109066768
3-N-cyclopropyl-1-N-[4-(diethylamino)phenyl]imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066771
1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066620
3-N-cyclohexyl-1-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068661
3-N-(4-tert-butylphenyl)-1-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066574
1-N-(4-cyanophenyl)-3-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068351
3-N-cyclohexyl-1-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068157
3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068336
1-N-[(4-chlorophenyl)methyl]-3-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068281
1-N-(3,4-difluorophenyl)-3-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067635
3-N-cyclopropyl-1-N-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066749
1-N-benzyl-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066660

Frequently Asked Questions

What is the IUPAC name of 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109066744) is 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide is O=C(Nc1ccc(F)c(Cl)c1)c1nc(C(=O)NC2CC2)n2ccccc12.
What is the InChIKey of 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is BIEQGQXBVMMXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClFN4O2/c19-12-9-11(6-7-13(12)20)22-17(25)15-14-3-1-2-8-24(14)16(23-15)18(26)21-10-4-5-10/h1-3,6-10H,4-5H2,(H,21,26)(H,22,25).
What are the key properties of 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide?
1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 372.79 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109066744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).