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

C20H24N2O2S — CID 134062209

IUPACN-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SMILESCC(c1ccccc1)N(C)C(=O)C1CCCN(C(=O)c2cccs2)C1
InChIInChI=1S/C20H24N2O2S/c1-15(16-8-4-3-5-9-16)21(2)19(23)17-10-6-12-22(14-17)20(24)18-11-7-13-25-18/h3-5,7-9,11,13,15,17H,6,10,12,14H2,1-2H3
InChIKeyVVMRNSWCURTZOQ-UHFFFAOYSA-N
MW356.49 g/mol
LogP3.82
Rot. Bonds4

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

N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide (PubChem CID 134062209) has the molecular formula C20H24N2O2S and a molecular weight of 356.49 g/mol. Its IUPAC name is N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
PubChem CID134062209
Molecular FormulaC20H24N2O2S
Molecular Weight356.49 g/mol
Exact Mass356.16
IUPAC NameN-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SMILESCC(c1ccccc1)N(C)C(=O)C1CCCN(C(=O)c2cccs2)C1
InChIInChI=1S/C20H24N2O2S/c1-15(16-8-4-3-5-9-16)21(2)19(23)17-10-6-12-22(14-17)20(24)18-11-7-13-25-18/h3-5,7-9,11,13,15,17H,6,10,12,14H2,1-2H3
InChIKeyVVMRNSWCURTZOQ-UHFFFAOYSA-N
XLogP3.82
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.49
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
N-[1-(4-chlorophenyl)ethyl]-N-methyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 42951798
N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 34152158
N-benzyl-N-(1-cyclopropylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42947669
N-(2,2-dimethyl-1-phenylpropyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55643259
N-cyclopentyl-N-ethyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 134061108
N-[1-(3-chlorophenyl)ethyl]-N-methyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 46591771
N-(2-phenyl-2-pyrrolidin-1-ylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 43053338
N-methyl-N-[(4-methylphenyl)methyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 43053389
(3S)-N-[(2R)-4-methylpentan-2-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 97013445
N-(4-propan-2-ylphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946825
[(3R)-3-phenylpiperidin-1-yl]-thiophen-2-ylmethanone
CID 740549

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide (CID 134062209) is N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide is CC(c1ccccc1)N(C)C(=O)C1CCCN(C(=O)c2cccs2)C1.
What is the InChIKey of N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The InChIKey is VVMRNSWCURTZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2S/c1-15(16-8-4-3-5-9-16)21(2)19(23)17-10-6-12-22(14-17)20(24)18-11-7-13-25-18/h3-5,7-9,11,13,15,17H,6,10,12,14H2,1-2H3.
What are the key properties of N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide has a molecular weight of 356.49 g/mol, XLogP of 3.82, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-phenylethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 134062209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).