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

C14H20ClN3O — CID 61053300

IUPAC4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide
SMILESCC(CNC(=O)c1cc(Cl)ccn1)N1CCCCC1
InChIInChI=1S/C14H20ClN3O/c1-11(18-7-3-2-4-8-18)10-17-14(19)13-9-12(15)5-6-16-13/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,17,19)
InChIKeyYVOLAFGCXVSYPN-UHFFFAOYSA-N
MW281.79 g/mol
LogP2.34
Rot. Bonds4

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

4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide (PubChem CID 61053300) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide
PubChem CID61053300
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide
SMILESCC(CNC(=O)c1cc(Cl)ccn1)N1CCCCC1
InChIInChI=1S/C14H20ClN3O/c1-11(18-7-3-2-4-8-18)10-17-14(19)13-9-12(15)5-6-16-13/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,17,19)
InChIKeyYVOLAFGCXVSYPN-UHFFFAOYSA-N
XLogP2.34
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-2-carboxamide
CID 61051288
4-chloro-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 86917672
5-chloro-2-fluoro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47031099
2-chloro-N-(2-piperidin-1-ylpropyl)pyridine-3-carboxamide
CID 61053126
2-bromo-N-(2-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 103754766
4-chloro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47187389
4-chloro-2-fluoro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47031098
2-(methylamino)-N-(2-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 62178431
N-methyl-4-(2-piperidin-1-ylpropylamino)pyridine-2-carboxamide
CID 61017690
3-hydroxy-N-[(2R)-2-pyrrolidin-1-ylpropyl]pyridine-2-carboxamide
CID 95284101
5-(methylamino)-N-(2-piperidin-1-ylpropyl)pyrazine-2-carboxamide
CID 107375177
N,N-dimethyl-4-(2-piperidin-1-ylpropylamino)pyridine-2-carboxamide
CID 61017944

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide (CID 61053300) is 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide is CC(CNC(=O)c1cc(Cl)ccn1)N1CCCCC1.
What is the InChIKey of 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide?
The InChIKey is YVOLAFGCXVSYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c1-11(18-7-3-2-4-8-18)10-17-14(19)13-9-12(15)5-6-16-13/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,17,19).
What are the key properties of 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide?
4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide has a molecular weight of 281.79 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-piperidin-1-ylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 61053300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).