5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide

C18H29N3O — CID 109195721

IUPAC5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide
SMILESCCCCCNC(=O)c1ccc(N2CCCCC2CC)cn1
InChIInChI=1S/C18H29N3O/c1-3-5-7-12-19-18(22)17-11-10-16(14-20-17)21-13-8-6-9-15(21)4-2/h10-11,14-15H,3-9,12-13H2,1-2H3,(H,19,22)
InChIKeyXDDPXKRHYWCAIH-UHFFFAOYSA-N
MW303.45 g/mol
LogP3.77
Rot. Bonds7

About 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide

5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide (PubChem CID 109195721) has the molecular formula C18H29N3O and a molecular weight of 303.45 g/mol. Its IUPAC name is 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide
PubChem CID109195721
Molecular FormulaC18H29N3O
Molecular Weight303.45 g/mol
Exact Mass303.23
IUPAC Name5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide
SMILESCCCCCNC(=O)c1ccc(N2CCCCC2CC)cn1
InChIInChI=1S/C18H29N3O/c1-3-5-7-12-19-18(22)17-11-10-16(14-20-17)21-13-8-6-9-15(21)4-2/h10-11,14-15H,3-9,12-13H2,1-2H3,(H,19,22)
InChIKeyXDDPXKRHYWCAIH-UHFFFAOYSA-N
XLogP3.77
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(2-ethylpiperidin-1-yl)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109194845
5-(2-ethylpiperidin-1-yl)-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2-carboxamide
CID 109194957
5-(2-ethylpiperidin-1-yl)-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109191491
5-(2-ethylazepan-1-yl)pyridine-2-carboxylic acid
CID 104690117
N-(4-chlorophenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196262
N-(4-ethoxyphenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196271
5-(4-methylpiperazin-1-yl)-N-pentylpyridine-2-carboxamide
CID 109186486
5-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109196298
N-benzyl-5-(2-ethylpiperidin-1-yl)-N-methylpyridine-2-carboxamide
CID 109189130
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyrazine-2-carboxamide
CID 109287769
N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109274707
N-pentyl-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274518

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide?
The IUPAC name of 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide (CID 109195721) is 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide.
What is the SMILES notation for 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide?
The canonical SMILES for 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide is CCCCCNC(=O)c1ccc(N2CCCCC2CC)cn1.
What is the InChIKey of 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide?
The InChIKey is XDDPXKRHYWCAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O/c1-3-5-7-12-19-18(22)17-11-10-16(14-20-17)21-13-8-6-9-15(21)4-2/h10-11,14-15H,3-9,12-13H2,1-2H3,(H,19,22).
What are the key properties of 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide?
5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide has a molecular weight of 303.45 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylpiperidin-1-yl)-N-pentylpyridine-2-carboxamide is sourced from PubChem (CID 109195721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).