3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide

C15H15ClN2O — CID 66482935

IUPAC3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide
SMILESCCCc1ccccc1NC(=O)c1ccncc1Cl
InChIInChI=1S/C15H15ClN2O/c1-2-5-11-6-3-4-7-14(11)18-15(19)12-8-9-17-10-13(12)16/h3-4,6-10H,2,5H2,1H3,(H,18,19)
InChIKeyXIIZKFNPJNEJPA-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.94
Rot. Bonds4

About 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide

3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide (PubChem CID 66482935) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide
PubChem CID66482935
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide
SMILESCCCc1ccccc1NC(=O)c1ccncc1Cl
InChIInChI=1S/C15H15ClN2O/c1-2-5-11-6-3-4-7-14(11)18-15(19)12-8-9-17-10-13(12)16/h3-4,6-10H,2,5H2,1H3,(H,18,19)
InChIKeyXIIZKFNPJNEJPA-UHFFFAOYSA-N
XLogP3.94
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 ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide
CID 66462437
4-chloro-6-methyl-N-(2-propylphenyl)pyridine-3-carboxamide
CID 81226564
3-chloro-N-(2-hydroxyphenyl)pyridine-4-carboxamide
CID 103715642
3-chloro-N-(2,3-dimethylphenyl)pyridine-4-carboxamide
CID 66462249
3-chloro-N-[2-(5-ethyltetrazol-1-yl)phenyl]pyridine-4-carboxamide
CID 122143190
3-chloro-N-(3-fluoro-2-methylphenyl)pyridine-4-carboxamide
CID 66484528
3-bromo-2-chloro-N-(2-propylphenyl)benzamide
CID 103988574
4-chloro-N-(2-propoxyphenyl)pyridine-3-carboxamide
CID 81226778
3-chloro-N-(5-chloro-2-propoxyphenyl)pyridine-4-carboxamide
CID 66462452
3-[2-[(3-hydroxypyridine-4-carbonyl)amino]phenyl]propanoic acid
CID 107272392
3-chloro-N-(2-methoxy-3-pyridinyl)pyridine-4-carboxamide
CID 66484881
3-chloro-N-[2-(dimethylamino)-3-pyridinyl]pyridine-4-carboxamide
CID 66482742

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide?
The IUPAC name of 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide (CID 66482935) is 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide is CCCc1ccccc1NC(=O)c1ccncc1Cl.
What is the InChIKey of 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide?
The InChIKey is XIIZKFNPJNEJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-2-5-11-6-3-4-7-14(11)18-15(19)12-8-9-17-10-13(12)16/h3-4,6-10H,2,5H2,1H3,(H,18,19).
What are the key properties of 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide?
3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide has a molecular weight of 274.75 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 66482935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).