3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide

C18H20N2O2S — CID 11142038

IUPAC3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)N(C(=O)c2cccs2)c2ccccc2)C1
InChIInChI=1S/C18H20N2O2S/c1-14-7-5-11-19(13-14)18(22)20(15-8-3-2-4-9-15)17(21)16-10-6-12-23-16/h2-4,6,8-10,12,14H,5,7,11,13H2,1H3
InChIKeyWRFKFRBMLOQPSZ-UHFFFAOYSA-N
MW328.44 g/mol
LogP4.25
Rot. Bonds2

About 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide

3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide (PubChem CID 11142038) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide
PubChem CID11142038
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC Name3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide
SMILESCC1CCCN(C(=O)N(C(=O)c2cccs2)c2ccccc2)C1
InChIInChI=1S/C18H20N2O2S/c1-14-7-5-11-19(13-14)18(22)20(15-8-3-2-4-9-15)17(21)16-10-6-12-23-16/h2-4,6,8-10,12,14H,5,7,11,13H2,1H3
InChIKeyWRFKFRBMLOQPSZ-UHFFFAOYSA-N
XLogP4.25
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,3-dimethyl-N-phenylpiperidine-1-carboxamide
CID 108990934
N-(4-methoxybenzoyl)-3-methyl-N-phenylpiperidine-1-carboxamide
CID 11100264
N-cyclopropyl-3-methyl-N-(thiophen-2-ylmethyl)piperidine-1-carboxamide
CID 116654649
[(3R)-3-phenylpiperidin-1-yl]-thiophen-2-ylmethanone
CID 740549
2-(4-methylazepan-1-yl)-1-thiophen-2-ylethanone
CID 63622264
(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 134062209
[(3S)-3-(methylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 94475795
butyl 3-[[N-(thiophene-2-carbonyl)anilino]methyl]piperidine-1-carboxylate
CID 142030476
(3-phenylpyrrolidin-1-yl)-thiophen-2-ylmethanone
CID 2908197
3-(3-methylphenyl)-1-(3-methylpiperidin-1-yl)-2-thiophen-2-ylprop-2-en-1-one
CID 74652739
2-(N-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]anilino)acetic acid
CID 51674289

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide (CID 11142038) is 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide is CC1CCCN(C(=O)N(C(=O)c2cccs2)c2ccccc2)C1.
What is the InChIKey of 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide?
The InChIKey is WRFKFRBMLOQPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S/c1-14-7-5-11-19(13-14)18(22)20(15-8-3-2-4-9-15)17(21)16-10-6-12-23-16/h2-4,6,8-10,12,14H,5,7,11,13H2,1H3.
What are the key properties of 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide?
3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide has a molecular weight of 328.44 g/mol, XLogP of 4.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-phenyl-N-(thiophene-2-carbonyl)piperidine-1-carboxamide is sourced from PubChem (CID 11142038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).