3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide

C15H23ClN4O — CID 62178316

IUPAC3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCCCN1CCC(NC(=O)c2nc(NC)ccc2Cl)CC1
InChIInChI=1S/C15H23ClN4O/c1-3-8-20-9-6-11(7-10-20)18-15(21)14-12(16)4-5-13(17-2)19-14/h4-5,11H,3,6-10H2,1-2H3,(H,17,19)(H,18,21)
InChIKeyCVKCEGKJYKGEJU-UHFFFAOYSA-N
MW310.83 g/mol
LogP2.38
Rot. Bonds5

About 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide

3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide (PubChem CID 62178316) has the molecular formula C15H23ClN4O and a molecular weight of 310.83 g/mol. Its IUPAC name is 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
PubChem CID62178316
Molecular FormulaC15H23ClN4O
Molecular Weight310.83 g/mol
Exact Mass310.16
IUPAC Name3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCCCN1CCC(NC(=O)c2nc(NC)ccc2Cl)CC1
InChIInChI=1S/C15H23ClN4O/c1-3-8-20-9-6-11(7-10-20)18-15(21)14-12(16)4-5-13(17-2)19-14/h4-5,11H,3,6-10H2,1-2H3,(H,17,19)(H,18,21)
InChIKeyCVKCEGKJYKGEJU-UHFFFAOYSA-N
XLogP2.38
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.83
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,6-dichloro-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
CID 60693528
3-chloro-N-cyclobutyl-6-(methylamino)pyridine-2-carboxamide
CID 62415036
3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide
CID 62173028
3-chloro-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 66484717
3-chloro-6-ethoxy-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 51092006
2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide
CID 17249839
3-chloro-N-(3-methoxycyclobutyl)-6-(methylamino)pyridine-2-carboxamide
CID 114120793
3-chloro-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-6-(methylamino)pyridine-2-carboxamide
CID 62174078
6-amino-3-chloro-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 62155799
N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249951
2-chloro-6-hydrazinyl-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 62241494
3-chloro-N-(cyclobutylmethyl)-6-(methylamino)pyridine-2-carboxamide
CID 55042718

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide (CID 62178316) is 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide is CCCN1CCC(NC(=O)c2nc(NC)ccc2Cl)CC1.
What is the InChIKey of 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide?
The InChIKey is CVKCEGKJYKGEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN4O/c1-3-8-20-9-6-11(7-10-20)18-15(21)14-12(16)4-5-13(17-2)19-14/h4-5,11H,3,6-10H2,1-2H3,(H,17,19)(H,18,21).
What are the key properties of 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide?
3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide has a molecular weight of 310.83 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 62178316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).