N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide

C20H25N3O — CID 109182897

IUPACN-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(N2CCCCC2)cn1)c1cccc(C)c1
InChIInChI=1S/C20H25N3O/c1-3-23(17-9-7-8-16(2)14-17)20(24)19-11-10-18(15-21-19)22-12-5-4-6-13-22/h7-11,14-15H,3-6,12-13H2,1-2H3
InChIKeyYZYWXSRHDUDJHX-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.05
Rot. Bonds4

About N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide

N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide (PubChem CID 109182897) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide
PubChem CID109182897
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(N2CCCCC2)cn1)c1cccc(C)c1
InChIInChI=1S/C20H25N3O/c1-3-23(17-9-7-8-16(2)14-17)20(24)19-11-10-18(15-21-19)22-12-5-4-6-13-22/h7-11,14-15H,3-6,12-13H2,1-2H3
InChIKeyYZYWXSRHDUDJHX-UHFFFAOYSA-N
XLogP4.05
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(3-methylphenyl)-5-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 109186597
5-(3,4-dihydro-1H-isoquinolin-2-yl)-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109192147
5-(dipropylamino)-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109196689
N-ethyl-N-(3-methylphenyl)-5-(3-methylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109288895
5-(azepan-1-yl)-N-ethyl-N-phenylpyrazine-2-carboxamide
CID 109289326
N-ethyl-N-(3-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044713
N-ethyl-N-(3-methylphenyl)-5-(propan-2-ylamino)pyrazine-2-carboxamide
CID 109271545
N-ethyl-N-(3-methylphenyl)-5-(1-phenylethylamino)pyridine-2-carboxamide
CID 109189083
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N,N-diethylpyridine-2-carboxamide
CID 109194309
1-(2-aminoethyl)-N-ethyl-N-(3-methylphenyl)imidazole-4-carboxamide
CID 107497434
N-ethyl-N-(3-methylphenyl)-3-piperidin-1-ylsulfonylbenzamide
CID 109063269
N-ethyl-N-(3-methylphenyl)-5-oxo-1-(4-pyrrolidin-1-ylphenyl)pyrrolidine-3-carboxamide
CID 113189843

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide (CID 109182897) is N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide is CCN(C(=O)c1ccc(N2CCCCC2)cn1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide?
The InChIKey is YZYWXSRHDUDJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-3-23(17-9-7-8-16(2)14-17)20(24)19-11-10-18(15-21-19)22-12-5-4-6-13-22/h7-11,14-15H,3-6,12-13H2,1-2H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide?
N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-5-piperidin-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 109182897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).