5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide

C15H14ClFN2O — CID 175249083

IUPAC5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide
SMILESCCNC(=O)c1cc(Cl)cnc1Cc1cccc(F)c1
InChIInChI=1S/C15H14ClFN2O/c1-2-18-15(20)13-8-11(16)9-19-14(13)7-10-4-3-5-12(17)6-10/h3-6,8-9H,2,7H2,1H3,(H,18,20)
InChIKeyGTTWZYBOOPFLKA-UHFFFAOYSA-N
MW292.74 g/mol
LogP3.21
Rot. Bonds4

About 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide

5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide (PubChem CID 175249083) has the molecular formula C15H14ClFN2O and a molecular weight of 292.74 g/mol. Its IUPAC name is 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide
PubChem CID175249083
Molecular FormulaC15H14ClFN2O
Molecular Weight292.74 g/mol
Exact Mass292.08
IUPAC Name5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide
SMILESCCNC(=O)c1cc(Cl)cnc1Cc1cccc(F)c1
InChIInChI=1S/C15H14ClFN2O/c1-2-18-15(20)13-8-11(16)9-19-14(13)7-10-4-3-5-12(17)6-10/h3-6,8-9H,2,7H2,1H3,(H,18,20)
InChIKeyGTTWZYBOOPFLKA-UHFFFAOYSA-N
XLogP3.21
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.74
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-5-fluoro-2-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
CID 174518381
5-chloro-N-[(3-fluorophenyl)methyl]-2-(methylamino)pyridine-4-carboxamide
CID 114922058
5-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide
CID 171547530
4-chloro-N-[2-(3-fluorophenyl)ethyl]-6-methylpyridine-3-carboxamide
CID 81226046
2,4-dichloro-N-[(3-fluorophenyl)methyl]benzamide
CID 127502749
N-[(3-fluorophenyl)methyl]-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81236117
2-chloro-4-[(3-fluorophenyl)methyl]-5-methylpyrimidine
CID 133188343
5-chloro-N-[(3-fluorophenyl)methyl]-2-methylsulfanylpyrimidine-4-carboxamide
CID 46586010
N-(5-chloro-2-pyridinyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
CID 86908832
6-chloro-N-[(3-fluorophenyl)methyl]pyridine-3-carboxamide
CID 24903422
N-[(3-fluorophenyl)methyl]-5-(propylamino)pyridine-2-carboxamide
CID 104640089
N-(5-chloropyrimidin-2-yl)-3-fluorobenzamide
CID 54265719

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide (CID 175249083) is 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide is CCNC(=O)c1cc(Cl)cnc1Cc1cccc(F)c1.
What is the InChIKey of 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide?
The InChIKey is GTTWZYBOOPFLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O/c1-2-18-15(20)13-8-11(16)9-19-14(13)7-10-4-3-5-12(17)6-10/h3-6,8-9H,2,7H2,1H3,(H,18,20).
What are the key properties of 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide?
5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide has a molecular weight of 292.74 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-2-[(3-fluorophenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 175249083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).