N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide

C15H16N2OS — CID 2163654

IUPACN-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
SMILESO=C(Nc1nc(-c2ccccc2)cs1)C1CCCC1
InChIInChI=1S/C15H16N2OS/c18-14(12-8-4-5-9-12)17-15-16-13(10-19-15)11-6-2-1-3-7-11/h1-3,6-7,10,12H,4-5,8-9H2,(H,16,17,18)
InChIKeyVLLMJSUJYDCLSQ-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.94
Rot. Bonds3

About N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide

N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide (PubChem CID 2163654) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
PubChem CID2163654
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
SMILESO=C(Nc1nc(-c2ccccc2)cs1)C1CCCC1
InChIInChI=1S/C15H16N2OS/c18-14(12-8-4-5-9-12)17-15-16-13(10-19-15)11-6-2-1-3-7-11/h1-3,6-7,10,12H,4-5,8-9H2,(H,16,17,18)
InChIKeyVLLMJSUJYDCLSQ-UHFFFAOYSA-N
XLogP3.94
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 7733333
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 1225742
cis-(1S,2R)-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1000957
cis-(1S,2R)-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamoyl]cyclohexane-1-carboxylate
CID 6958915
N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 9246504
N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 733841
N-[4-[1-oxo-1-[(4-phenyl-1,3-thiazol-2-yl)amino]propan-2-yl]sulfanylphenyl]cyclohexanecarboxamide
CID 19712121
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 9246518
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 733842
(2R)-1-(benzenesulfonyl)-N-(4-phenyl-1,3-thiazol-2-yl)piperidine-2-carboxamide
CID 2318282
1-methylsulfonyl-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]piperidine-3-carboxamide
CID 43043803

Frequently Asked Questions

What is the IUPAC name of N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
The IUPAC name of N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide (CID 2163654) is N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide is O=C(Nc1nc(-c2ccccc2)cs1)C1CCCC1.
What is the InChIKey of N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
The InChIKey is VLLMJSUJYDCLSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c18-14(12-8-4-5-9-12)17-15-16-13(10-19-15)11-6-2-1-3-7-11/h1-3,6-7,10,12H,4-5,8-9H2,(H,16,17,18).
What are the key properties of N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide has a molecular weight of 272.37 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide is sourced from PubChem (CID 2163654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).