N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide

C15H23N3O — CID 100628883

IUPACN-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
SMILESCC1CCN(CCCNC(=O)c2cccnc2)CC1
InChIInChI=1S/C15H23N3O/c1-13-5-10-18(11-6-13)9-3-8-17-15(19)14-4-2-7-16-12-14/h2,4,7,12-13H,3,5-6,8-11H2,1H3,(H,17,19)
InChIKeyWINXZPQKMXFSFY-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.93
Rot. Bonds5

About N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide

N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide (PubChem CID 100628883) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
PubChem CID100628883
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
SMILESCC1CCN(CCCNC(=O)c2cccnc2)CC1
InChIInChI=1S/C15H23N3O/c1-13-5-10-18(11-6-13)9-3-8-17-15(19)14-4-2-7-16-12-14/h2,4,7,12-13H,3,5-6,8-11H2,1H3,(H,17,19)
InChIKeyWINXZPQKMXFSFY-UHFFFAOYSA-N
XLogP1.93
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.93
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

N-[2-[[N'-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]carbamimidoyl]amino]ethyl]pyridine-3-carboxamide;hydroiodide
CID 111387720
N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride
CID 2909951
N-[5-(4-ethylpiperazin-1-yl)pentyl]pyridine-3-carboxamide
CID 110442851
3-bromo-N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide
CID 107518109
N-[3-[(2R)-2-ethylpiperidin-1-yl]propyl]pyridine-3-carboxamide
CID 100629368
N-(3-pyrrol-1-ylpropyl)pyridine-3-carboxamide
CID 90500651
N-[3-(4-methylpiperidin-1-yl)propyl]-3-phenylimidazole-4-carboxamide
CID 35416761
N-[3-(4-methylpiperidin-1-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide
CID 35417488
N-[3-(4-methylpiperidin-1-yl)propyl]-6-oxo-1H-pyridine-3-carboxamide
CID 30541274
5-bromo-N-[3-(4-methylpiperidin-1-yl)propyl]furan-2-carboxamide
CID 35416141
N-[2-[[(3R,4R)-3,4-dimethylpiperidine-1-carbonyl]amino]ethyl]pyridine-3-carboxamide
CID 124595352
N-[3-[1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]propyl]pyridine-3-carboxamide
CID 16964538

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide (CID 100628883) is N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide is CC1CCN(CCCNC(=O)c2cccnc2)CC1.
What is the InChIKey of N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide?
The InChIKey is WINXZPQKMXFSFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-13-5-10-18(11-6-13)9-3-8-17-15(19)14-4-2-7-16-12-14/h2,4,7,12-13H,3,5-6,8-11H2,1H3,(H,17,19).
What are the key properties of N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide?
N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 100628883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).