4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide

C15H22ClN3O — CID 61051288

IUPAC4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide
SMILESCC(CNC(=O)c1cc(Cl)ccn1)CN1CCCCC1
InChIInChI=1S/C15H22ClN3O/c1-12(11-19-7-3-2-4-8-19)10-18-15(20)14-9-13(16)5-6-17-14/h5-6,9,12H,2-4,7-8,10-11H2,1H3,(H,18,20)
InChIKeyGBTWKKZSBFNTEP-UHFFFAOYSA-N
MW295.81 g/mol
LogP2.59
Rot. Bonds5

About 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide

4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide (PubChem CID 61051288) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide
PubChem CID61051288
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC Name4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide
SMILESCC(CNC(=O)c1cc(Cl)ccn1)CN1CCCCC1
InChIInChI=1S/C15H22ClN3O/c1-12(11-19-7-3-2-4-8-19)10-18-15(20)14-9-13(16)5-6-17-14/h5-6,9,12H,2-4,7-8,10-11H2,1H3,(H,18,20)
InChIKeyGBTWKKZSBFNTEP-UHFFFAOYSA-N
XLogP2.59
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide
CID 61053300
4-chloro-N-[(2S)-3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]pyridine-2-carboxamide
CID 94732274
2-amino-5-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 61139853
2-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 61292554
5-chloro-2-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 47308839
2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
CID 106686782
N-(2-methyl-3-morpholin-4-ylpropyl)pyridine-2-carboxamide
CID 110444324
4-bromo-3-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 81295079
3-bromo-4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 107999448
4-chloro-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 86917672
N,N-dimethyl-4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-2-carboxamide
CID 62992312
5-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)thiophene-3-carboxamide
CID 54907003

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide (CID 61051288) is 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide is CC(CNC(=O)c1cc(Cl)ccn1)CN1CCCCC1.
What is the InChIKey of 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide?
The InChIKey is GBTWKKZSBFNTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O/c1-12(11-19-7-3-2-4-8-19)10-18-15(20)14-9-13(16)5-6-17-14/h5-6,9,12H,2-4,7-8,10-11H2,1H3,(H,18,20).
What are the key properties of 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide?
4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide has a molecular weight of 295.81 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 61051288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).