N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride

C12H18ClN3O2 — CID 119323041

IUPACN-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.Cn1cccc(NC(=O)C2CCCCN2)c1=O
InChIInChI=1S/C12H17N3O2.ClH/c1-15-8-4-6-10(12(15)17)14-11(16)9-5-2-3-7-13-9;/h4,6,8-9,13H,2-3,5,7H2,1H3,(H,14,16);1H
InChIKeySHMOJAHXUYWOPM-UHFFFAOYSA-N
MW271.75 g/mol
LogP0.89
Rot. Bonds2

About N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride

N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119323041) has the molecular formula C12H18ClN3O2 and a molecular weight of 271.75 g/mol. Its IUPAC name is N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride
PubChem CID119323041
Molecular FormulaC12H18ClN3O2
Molecular Weight271.75 g/mol
Exact Mass271.11
IUPAC NameN-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.Cn1cccc(NC(=O)C2CCCCN2)c1=O
InChIInChI=1S/C12H17N3O2.ClH/c1-15-8-4-6-10(12(15)17)14-11(16)9-5-2-3-7-13-9;/h4,6,8-9,13H,2-3,5,7H2,1H3,(H,14,16);1H
InChIKeySHMOJAHXUYWOPM-UHFFFAOYSA-N
XLogP0.89
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride (CID 119323041) is N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride is Cl.Cn1cccc(NC(=O)C2CCCCN2)c1=O.
What is the InChIKey of N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is SHMOJAHXUYWOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2.ClH/c1-15-8-4-6-10(12(15)17)14-11(16)9-5-2-3-7-13-9;/h4,6,8-9,13H,2-3,5,7H2,1H3,(H,14,16);1H.
What are the key properties of N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride?
N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 271.75 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-2-oxo-3-pyridinyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119323041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).