4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide

C12H14ClN3O2 — CID 64669402

IUPAC4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide
SMILESCN1CC(NC(=O)c2cc(Cl)ccn2)CCC1=O
InChIInChI=1S/C12H14ClN3O2/c1-16-7-9(2-3-11(16)17)15-12(18)10-6-8(13)4-5-14-10/h4-6,9H,2-3,7H2,1H3,(H,15,18)
InChIKeyWYJNYQFNZSOXDL-UHFFFAOYSA-N
MW267.72 g/mol
LogP1.09
Rot. Bonds2

About 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide

4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide (PubChem CID 64669402) has the molecular formula C12H14ClN3O2 and a molecular weight of 267.72 g/mol. Its IUPAC name is 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide
PubChem CID64669402
Molecular FormulaC12H14ClN3O2
Molecular Weight267.72 g/mol
Exact Mass267.08
IUPAC Name4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide
SMILESCN1CC(NC(=O)c2cc(Cl)ccn2)CCC1=O
InChIInChI=1S/C12H14ClN3O2/c1-16-7-9(2-3-11(16)17)15-12(18)10-6-8(13)4-5-14-10/h4-6,9H,2-3,7H2,1H3,(H,15,18)
InChIKeyWYJNYQFNZSOXDL-UHFFFAOYSA-N
XLogP1.09
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.72
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 64669449
6-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridazine-3-carboxamide
CID 64669604
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 64667254
2-bromo-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 103752814
2-bromo-4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 103765334
N-methyl-4-[(1-methyl-6-oxopiperidin-3-yl)amino]pyridine-2-carboxamide
CID 64667795
2-(methylamino)-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 64669853
4-chloro-N-(1,2-dimethylpiperidin-4-yl)pyridine-2-carboxamide
CID 79005580
4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-carboxamide
CID 81232502
5,6-dichloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-carboxamide
CID 64670220
4-chloro-N-cyclopent-3-en-1-ylpyridine-2-carboxamide
CID 115696706
5-chloro-2-(ethylamino)-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64667455

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide (CID 64669402) is 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide is CN1CC(NC(=O)c2cc(Cl)ccn2)CCC1=O.
What is the InChIKey of 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide?
The InChIKey is WYJNYQFNZSOXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3O2/c1-16-7-9(2-3-11(16)17)15-12(18)10-6-8(13)4-5-14-10/h4-6,9H,2-3,7H2,1H3,(H,15,18).
What are the key properties of 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide?
4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide has a molecular weight of 267.72 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 64669402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).