N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide

C16H16ClNOS — CID 42435317

IUPACN-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)C1(c2cccs2)CCCC1
InChIInChI=1S/C16H16ClNOS/c17-12-5-3-6-13(11-12)18-15(19)16(8-1-2-9-16)14-7-4-10-20-14/h3-7,10-11H,1-2,8-9H2,(H,18,19)
InChIKeyUMWCTXHVNSUMQA-UHFFFAOYSA-N
MW305.83 g/mol
LogP4.85
Rot. Bonds3

About N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide

N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide (PubChem CID 42435317) has the molecular formula C16H16ClNOS and a molecular weight of 305.83 g/mol. Its IUPAC name is N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
PubChem CID42435317
Molecular FormulaC16H16ClNOS
Molecular Weight305.83 g/mol
Exact Mass305.06
IUPAC NameN-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)C1(c2cccs2)CCCC1
InChIInChI=1S/C16H16ClNOS/c17-12-5-3-6-13(11-12)18-15(19)16(8-1-2-9-16)14-7-4-10-20-14/h3-7,10-11H,1-2,8-9H2,(H,18,19)
InChIKeyUMWCTXHVNSUMQA-UHFFFAOYSA-N
XLogP4.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.83
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435589
N-(2-fluorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435427
N-(2,4-difluorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435435
1-(3-chlorophenyl)-N-pyridin-4-ylcyclohexane-1-carboxamide
CID 60542537
N-(3-chlorophenyl)-1-(3,4-dimethoxyphenyl)cyclopentane-1-carboxamide
CID 2014049
N-(3-nitrophenyl)-4-thiophen-2-yloxane-4-carboxamide
CID 7243583
1-[(3-chlorophenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62096058
N-(4-acetylphenyl)-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 110698475
N-(2-methoxyphenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 42435562
1-(3-chlorophenyl)-N-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 31779380
2-(1-aminocyclopentyl)-N-(3-chlorophenyl)acetamide
CID 64685930
3-[[1-(3-chlorophenyl)cyclohexanecarbonyl]amino]-N-cyclopropylbenzamide
CID 134047957

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide (CID 42435317) is N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide is O=C(Nc1cccc(Cl)c1)C1(c2cccs2)CCCC1.
What is the InChIKey of N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide?
The InChIKey is UMWCTXHVNSUMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNOS/c17-12-5-3-6-13(11-12)18-15(19)16(8-1-2-9-16)14-7-4-10-20-14/h3-7,10-11H,1-2,8-9H2,(H,18,19).
What are the key properties of N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide?
N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide has a molecular weight of 305.83 g/mol, XLogP of 4.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-1-thiophen-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 42435317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).