N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride

C11H20ClN3O2 — CID 120598192

IUPACN-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
SMILESCC1CC(NC(=O)C2CNC(=O)C2)CCN1.Cl
InChIInChI=1S/C11H19N3O2.ClH/c1-7-4-9(2-3-12-7)14-11(16)8-5-10(15)13-6-8;/h7-9,12H,2-6H2,1H3,(H,13,15)(H,14,16);1H
InChIKeyZEJGQQBDWPEYOS-UHFFFAOYSA-N
MW261.75 g/mol
LogP-0.20
Rot. Bonds2

About N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride

N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride (PubChem CID 120598192) has the molecular formula C11H20ClN3O2 and a molecular weight of 261.75 g/mol. Its IUPAC name is N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
PubChem CID120598192
Molecular FormulaC11H20ClN3O2
Molecular Weight261.75 g/mol
Exact Mass261.12
IUPAC NameN-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
SMILESCC1CC(NC(=O)C2CNC(=O)C2)CCN1.Cl
InChIInChI=1S/C11H19N3O2.ClH/c1-7-4-9(2-3-12-7)14-11(16)8-5-10(15)13-6-8;/h7-9,12H,2-6H2,1H3,(H,13,15)(H,14,16);1H
InChIKeyZEJGQQBDWPEYOS-UHFFFAOYSA-N
XLogP-0.20
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 5-0.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethylcyclohexyl)-5-oxopyrrolidine-3-carboxamide
CID 78998864
4-methyl-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995297
1-methyl-N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 120600934
4,4-difluoro-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995432
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-5-oxopyrrolidine-3-carboxamide
CID 78983234
4-tert-butyl-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995414
cis-(1R,3S)-3-[(6-oxopiperidine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106321143
N-(4-ethylcyclohexyl)-5-oxopyrrolidine-3-carboxamide
CID 78981785
2,2-dimethyl-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
CID 120599635
6-oxo-N-[(3S)-pyrrolidin-3-yl]piperidine-3-carboxamide
CID 83192394
(2S,4S)-N-(1-cyclopropyl-5-oxopyrrolidin-3-yl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120633713
[(2R,4R)-2-methylpiperidin-4-yl]carbamic acid
CID 146485805

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride (CID 120598192) is N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride is CC1CC(NC(=O)C2CNC(=O)C2)CCN1.Cl.
What is the InChIKey of N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is ZEJGQQBDWPEYOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2.ClH/c1-7-4-9(2-3-12-7)14-11(16)8-5-10(15)13-6-8;/h7-9,12H,2-6H2,1H3,(H,13,15)(H,14,16);1H.
What are the key properties of N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride?
N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 261.75 g/mol, XLogP of -0.20, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-4-yl)-5-oxopyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 120598192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).