N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide

C17H12FN3O2S — CID 1449346

IUPACN-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2ccccc2F)nc1)c1cccs1
InChIInChI=1S/C17H12FN3O2S/c18-13-5-2-1-4-12(13)16(22)21-15-8-7-11(10-19-15)20-17(23)14-6-3-9-24-14/h1-10H,(H,20,23)(H,19,21,22)
InChIKeyCHOUNUWLKHIUNO-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.79
Rot. Bonds4

About N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide

N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide (PubChem CID 1449346) has the molecular formula C17H12FN3O2S and a molecular weight of 341.37 g/mol. Its IUPAC name is N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide
PubChem CID1449346
Molecular FormulaC17H12FN3O2S
Molecular Weight341.37 g/mol
Exact Mass341.06
IUPAC NameN-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2ccccc2F)nc1)c1cccs1
InChIInChI=1S/C17H12FN3O2S/c18-13-5-2-1-4-12(13)16(22)21-15-8-7-11(10-19-15)20-17(23)14-6-3-9-24-14/h1-10H,(H,20,23)(H,19,21,22)
InChIKeyCHOUNUWLKHIUNO-UHFFFAOYSA-N
XLogP3.79
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]thiophene-2-carboxamide
CID 113026990
N-[6-(thiophene-2-carbonylamino)-3-pyridinyl]pyridine-4-carboxamide
CID 1449478
N-[5-[4-(trifluoromethyl)anilino]-2-pyridinyl]thiophene-2-carboxamide
CID 113034907
N-[6-[4-(trifluoromethyl)anilino]-3-pyridinyl]thiophene-2-carboxamide
CID 113020253
2-fluoro-N-[6-[2-(trifluoromethyl)anilino]-3-pyridinyl]benzamide
CID 113020153
N-[6-(2-methylanilino)-3-pyridinyl]thiophene-2-carboxamide
CID 113016087
N-(5-chloro-2-pyridinyl)-2-fluorobenzamide;hydrochloride
CID 163325720
N-[5-(tert-butylamino)-2-pyridinyl]-2-fluorobenzamide
CID 113029972
2-fluoro-N-[5-[4-(trifluoromethyl)anilino]-2-pyridinyl]benzamide
CID 113034912
2-fluoro-N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]benzamide
CID 113026995
N-[6-(4-acetamidoanilino)-3-pyridinyl]-2-fluorobenzamide
CID 113020547
N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]thiophene-2-carboxamide
CID 113027177

Frequently Asked Questions

What is the IUPAC name of N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide?
The IUPAC name of N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide (CID 1449346) is N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide?
The canonical SMILES for N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide is O=C(Nc1ccc(NC(=O)c2ccccc2F)nc1)c1cccs1.
What is the InChIKey of N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide?
The InChIKey is CHOUNUWLKHIUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FN3O2S/c18-13-5-2-1-4-12(13)16(22)21-15-8-7-11(10-19-15)20-17(23)14-6-3-9-24-14/h1-10H,(H,20,23)(H,19,21,22).
What are the key properties of N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide?
N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(2-fluorobenzoyl)amino]-3-pyridinyl]thiophene-2-carboxamide is sourced from PubChem (CID 1449346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).