N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide

C11H17N3O — CID 115159891

IUPACN-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide
SMILESCN(C(=O)C1CCCNC1)c1ccc[nH]1
InChIInChI=1S/C11H17N3O/c1-14(10-5-3-7-13-10)11(15)9-4-2-6-12-8-9/h3,5,7,9,12-13H,2,4,6,8H2,1H3
InChIKeyIJPSGLCRCRAPLS-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.98
Rot. Bonds2

About N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide

N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide (PubChem CID 115159891) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide
PubChem CID115159891
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide
SMILESCN(C(=O)C1CCCNC1)c1ccc[nH]1
InChIInChI=1S/C11H17N3O/c1-14(10-5-3-7-13-10)11(15)9-4-2-6-12-8-9/h3,5,7,9,12-13H,2,4,6,8H2,1H3
InChIKeyIJPSGLCRCRAPLS-UHFFFAOYSA-N
XLogP0.98
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-N-methylpiperidine-3-carboxamide
CID 91609234
N-methyl-N-(1H-pyrrol-3-yl)piperidine-3-carboxamide
CID 115159892
N-methyl-N-naphthalen-2-ylpiperidine-3-carboxamide
CID 115159907
(3S)-N,N-dimethylpiperidine-3-carboxamide
CID 11469201
N-(4-ethylphenyl)-N-methylpiperidine-3-carboxamide
CID 62002081
N-(3,5-dimethylphenyl)-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119300463
N-(3,4-difluorophenyl)-N-methylpiperidine-3-carboxamide
CID 115159889
N-(5-bromothiophen-2-yl)-N-methylpiperidine-3-carboxamide
CID 115159883
(3R)-N-(3-methoxyphenyl)-N-methylpiperidine-3-carboxamide
CID 81140173
(3S)-N-methoxy-N-methylpiperidine-3-carboxamide
CID 81140301
N-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 115159880
N-methyl-N-(piperidin-3-ylmethyl)-1H-pyrrol-2-amine
CID 115209574

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide (CID 115159891) is N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide is CN(C(=O)C1CCCNC1)c1ccc[nH]1.
What is the InChIKey of N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide?
The InChIKey is IJPSGLCRCRAPLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-14(10-5-3-7-13-10)11(15)9-4-2-6-12-8-9/h3,5,7,9,12-13H,2,4,6,8H2,1H3.
What are the key properties of N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide?
N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 0.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1H-pyrrol-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 115159891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).