1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C18H14F2N4O2 — CID 109066620

IUPAC1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESO=C(NC1CC1)c1nc(C(=O)Nc2ccc(F)cc2F)n2ccccc12
InChIInChI=1S/C18H14F2N4O2/c19-10-4-7-13(12(20)9-10)22-18(26)16-23-15(17(25)21-11-5-6-11)14-3-1-2-8-24(14)16/h1-4,7-9,11H,5-6H2,(H,21,25)(H,22,26)
InChIKeyZOXNPOGYAWDSMS-UHFFFAOYSA-N
MW356.33 g/mol
LogP2.76
Rot. Bonds4

About 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109066620) has the molecular formula C18H14F2N4O2 and a molecular weight of 356.33 g/mol. Its IUPAC name is 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109066620
Molecular FormulaC18H14F2N4O2
Molecular Weight356.33 g/mol
Exact Mass356.11
IUPAC Name1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESO=C(NC1CC1)c1nc(C(=O)Nc2ccc(F)cc2F)n2ccccc12
InChIInChI=1S/C18H14F2N4O2/c19-10-4-7-13(12(20)9-10)22-18(26)16-23-15(17(25)21-11-5-6-11)14-3-1-2-8-24(14)16/h1-4,7-9,11H,5-6H2,(H,21,25)(H,22,26)
InChIKeyZOXNPOGYAWDSMS-UHFFFAOYSA-N
XLogP2.76
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.33
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-difluorophenyl)-3-(3-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071656
3-N-cyclohexyl-1-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068157
3-N-cyclopropyl-1-N-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066749
1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066744
3-N-(2-fluorophenyl)-1-N-(4-fluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109072044
3-N-(4-tert-butylphenyl)-1-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066574
3-N-cyclohexyl-1-N-(2,5-dimethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068666
1-N-benzyl-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066660
1-N-cyclohexyl-3-N-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068614
1-N-(3-fluorophenyl)-3-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071855
3-N-(2-fluorophenyl)-1-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067464
1-N-cyclopropyl-3-N-methyl-3-N-phenylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066555

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109066620) is 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is O=C(NC1CC1)c1nc(C(=O)Nc2ccc(F)cc2F)n2ccccc12.
What is the InChIKey of 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is ZOXNPOGYAWDSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N4O2/c19-10-4-7-13(12(20)9-10)22-18(26)16-23-15(17(25)21-11-5-6-11)14-3-1-2-8-24(14)16/h1-4,7-9,11H,5-6H2,(H,21,25)(H,22,26).
What are the key properties of 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 356.33 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopropyl-3-N-(2,4-difluorophenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109066620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).