1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide

C19H14FN3OS — CID 134794085

IUPAC1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCc1cccs1)c1nc(-c2ccc(F)cc2)c2ccccn12
InChIInChI=1S/C19H14FN3OS/c20-14-8-6-13(7-9-14)17-16-5-1-2-10-23(16)18(22-17)19(24)21-12-15-4-3-11-25-15/h1-11H,12H2,(H,21,24)
InChIKeyMRDMSFFNYIXSDR-UHFFFAOYSA-N
MW351.41 g/mol
LogP4.13
Rot. Bonds4

About 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide

1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 134794085) has the molecular formula C19H14FN3OS and a molecular weight of 351.41 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID134794085
Molecular FormulaC19H14FN3OS
Molecular Weight351.41 g/mol
Exact Mass351.08
IUPAC Name1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCc1cccs1)c1nc(-c2ccc(F)cc2)c2ccccn12
InChIInChI=1S/C19H14FN3OS/c20-14-8-6-13(7-9-14)17-16-5-1-2-10-23(16)18(22-17)19(24)21-12-15-4-3-11-25-15/h1-11H,12H2,(H,21,24)
InChIKeyMRDMSFFNYIXSDR-UHFFFAOYSA-N
XLogP4.13
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 134794085) is 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide is O=C(NCc1cccs1)c1nc(-c2ccc(F)cc2)c2ccccn12.
What is the InChIKey of 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is MRDMSFFNYIXSDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3OS/c20-14-8-6-13(7-9-14)17-16-5-1-2-10-23(16)18(22-17)19(24)21-12-15-4-3-11-25-15/h1-11H,12H2,(H,21,24).
What are the key properties of 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 134794085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).