N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide

C15H15ClN2O — CID 11608789

IUPACN-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide
SMILESCc1cncc(C(=O)NCCc2ccccc2Cl)c1
InChIInChI=1S/C15H15ClN2O/c1-11-8-13(10-17-9-11)15(19)18-7-6-12-4-2-3-5-14(12)16/h2-5,8-10H,6-7H2,1H3,(H,18,19)
InChIKeyULZHKVNYGFNEMR-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.02
Rot. Bonds4

About N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide

N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide (PubChem CID 11608789) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide
PubChem CID11608789
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC NameN-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide
SMILESCc1cncc(C(=O)NCCc2ccccc2Cl)c1
InChIInChI=1S/C15H15ClN2O/c1-11-8-13(10-17-9-11)15(19)18-7-6-12-4-2-3-5-14(12)16/h2-5,8-10H,6-7H2,1H3,(H,18,19)
InChIKeyULZHKVNYGFNEMR-UHFFFAOYSA-N
XLogP3.02
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-hydroxy-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 78953956
N-[(2-chlorophenyl)methyl]-5-[2-(2-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109233796
N-[3-[4-(2-fluorophenyl)phenyl]propyl]-5-methylpyridine-3-carboxamide
CID 138674657
N-[2-(2-fluorophenyl)ethyl]-5-(4-methylanilino)pyridine-3-carboxamide
CID 109236255
5-N-(3,5-dimethylphenyl)-3-N-[2-(2-fluorophenyl)ethyl]pyridine-3,5-dicarboxamide
CID 109106326
3,4-dichloro-N-[2-(2-methylphenyl)ethyl]benzamide
CID 27837884
6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 78990903
5-(4-chloro-2-methylanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236280
3-N-[2-(2,4-dichlorophenyl)ethyl]-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101412
N-[2,2-dimethyl-3-[(5-methylpyridine-3-carbonyl)amino]propyl]-5-methylpyridine-3-carboxamide
CID 71994778
N-[(2-chlorophenyl)methyl]-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223386
N-[2-(2-chlorophenyl)ethyl]-1-phenylpyrazole-4-carboxamide
CID 50772841

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide?
The IUPAC name of N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide (CID 11608789) is N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide is Cc1cncc(C(=O)NCCc2ccccc2Cl)c1.
What is the InChIKey of N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide?
The InChIKey is ULZHKVNYGFNEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-11-8-13(10-17-9-11)15(19)18-7-6-12-4-2-3-5-14(12)16/h2-5,8-10H,6-7H2,1H3,(H,18,19).
What are the key properties of N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide?
N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide has a molecular weight of 274.75 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)ethyl]-5-methylpyridine-3-carboxamide is sourced from PubChem (CID 11608789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).