5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide

C20H25N3O — CID 109182187

IUPAC5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)NC2CCCC2)nc1
InChIInChI=1S/C20H25N3O/c1-2-23(15-16-8-4-3-5-9-16)18-12-13-19(21-14-18)20(24)22-17-10-6-7-11-17/h3-5,8-9,12-14,17H,2,6-7,10-11,15H2,1H3,(H,22,24)
InChIKeyMHRAJKQKUTWHBQ-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.78
Rot. Bonds6

About 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide

5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide (PubChem CID 109182187) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide
PubChem CID109182187
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide
SMILESCCN(Cc1ccccc1)c1ccc(C(=O)NC2CCCC2)nc1
InChIInChI=1S/C20H25N3O/c1-2-23(15-16-8-4-3-5-9-16)18-12-13-19(21-14-18)20(24)22-17-10-6-7-11-17/h3-5,8-9,12-14,17H,2,6-7,10-11,15H2,1H3,(H,22,24)
InChIKeyMHRAJKQKUTWHBQ-UHFFFAOYSA-N
XLogP3.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[benzyl(methyl)amino]-N-cycloheptylpyridine-2-carboxamide
CID 109189250
4-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide
CID 109204016
5-[benzyl(methyl)amino]-N-cyclopropylpyridine-2-carboxamide
CID 109179860
4-[benzyl(ethyl)amino]-N-cycloheptylpyridine-2-carboxamide
CID 109212597
5-[benzyl(propan-2-yl)amino]-N-cyclopropylpyridine-2-carboxamide
CID 109179910
2-[benzyl(ethyl)amino]-N-cyclohexylpyrimidine-4-carboxamide
CID 109298800
5-[benzyl(ethyl)amino]-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109190822
5-[benzyl(ethyl)amino]-N-butan-2-ylpyridine-2-carboxamide
CID 109181423
5-[benzyl(ethyl)amino]-N-(3,4-dimethylphenyl)pyridine-2-carboxamide
CID 109190828
5-[benzyl(ethyl)amino]-N-(3,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109190853
5-(diethylamino)-N-phenylpyridine-2-carboxamide
CID 109194733
3-[4-[benzyl(ethyl)amino]phenyl]-2-cyano-N-cyclohexylprop-2-enamide
CID 3551166

Frequently Asked Questions

What is the IUPAC name of 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide?
The IUPAC name of 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide (CID 109182187) is 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide.
What is the SMILES notation for 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide?
The canonical SMILES for 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide is CCN(Cc1ccccc1)c1ccc(C(=O)NC2CCCC2)nc1.
What is the InChIKey of 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide?
The InChIKey is MHRAJKQKUTWHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-2-23(15-16-8-4-3-5-9-16)18-12-13-19(21-14-18)20(24)22-17-10-6-7-11-17/h3-5,8-9,12-14,17H,2,6-7,10-11,15H2,1H3,(H,22,24).
What are the key properties of 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide?
5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[benzyl(ethyl)amino]-N-cyclopentylpyridine-2-carboxamide is sourced from PubChem (CID 109182187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).