N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide

C18H21NOS — CID 42435282

IUPACN-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide
SMILESCN(Cc1ccccc1)C(=O)C1(c2cccs2)CCCC1
InChIInChI=1S/C18H21NOS/c1-19(14-15-8-3-2-4-9-15)17(20)18(11-5-6-12-18)16-10-7-13-21-16/h2-4,7-10,13H,5-6,11-12,14H2,1H3
InChIKeyYKULLPBUCQFXPL-UHFFFAOYSA-N
MW299.44 g/mol
LogP4.22
Rot. Bonds4

About N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide

N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide (PubChem CID 42435282) has the molecular formula C18H21NOS and a molecular weight of 299.44 g/mol. Its IUPAC name is N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide
PubChem CID42435282
Molecular FormulaC18H21NOS
Molecular Weight299.44 g/mol
Exact Mass299.13
IUPAC NameN-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide
SMILESCN(Cc1ccccc1)C(=O)C1(c2cccs2)CCCC1
InChIInChI=1S/C18H21NOS/c1-19(14-15-8-3-2-4-9-15)17(20)18(11-5-6-12-18)16-10-7-13-21-16/h2-4,7-10,13H,5-6,11-12,14H2,1H3
InChIKeyYKULLPBUCQFXPL-UHFFFAOYSA-N
XLogP4.22
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-phenylpropyl)-2-thiophen-2-ylacetamide
CID 2299844
(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-thiophen-2-ylmethanone
CID 2567966
N-benzyl-N-(2-cyanoethyl)thiophene-2-carboxamide
CID 2813034
N-(4-phenylbutan-2-yl)-2-(thiophen-2-yl)acetamide
CID 2914787
N-[(2-fluorophenyl)methyl]-2-thiophen-3-ylacetamide
CID 8013080
4-Benzylpiperazinyl 2-thienyl ketone
CID 757483
N-methyl-N-[(3-methylthiophen-2-yl)methyl]adamantane-1-carboxamide
CID 51186945
2-Adamantan-1-yl-N-methyl-N-thiophen-2-ylmethyl-acetamide
CID 57576905
N-methyl-N-(thiophen-2-ylmethyl)adamantane-1-carboxamide
CID 57577004
(E)-N-ethyl-3-(4-methylphenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide
CID 67511313
N-ethyl-3-(4-methylphenyl)-N-(thiophen-2-ylmethyl)propanamide
CID 67512015
N-methyl-1-(4-methylphenyl)-N-(thiophen-2-ylmethyl)cyclopropane-1-carboxamide
CID 71449606

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide?
The IUPAC name of N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide (CID 42435282) is N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide is CN(Cc1ccccc1)C(=O)C1(c2cccs2)CCCC1.
What is the InChIKey of N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide?
The InChIKey is YKULLPBUCQFXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NOS/c1-19(14-15-8-3-2-4-9-15)17(20)18(11-5-6-12-18)16-10-7-13-21-16/h2-4,7-10,13H,5-6,11-12,14H2,1H3.
What are the key properties of N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide?
N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide has a molecular weight of 299.44 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-1-thiophen-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 42435282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).