N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

C16H18N2OS — CID 9123866

IUPACN-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccccc2)sc1C(=O)NC1CCCC1
InChIInChI=1S/C16H18N2OS/c1-11-14(15(19)18-13-9-5-6-10-13)20-16(17-11)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-10H2,1H3,(H,18,19)
InChIKeyWKUCHBGDOUVQPM-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.79
Rot. Bonds3

About N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide (PubChem CID 9123866) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
PubChem CID9123866
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC NameN-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccccc2)sc1C(=O)NC1CCCC1
InChIInChI=1S/C16H18N2OS/c1-11-14(15(19)18-13-9-5-6-10-13)20-16(17-11)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-10H2,1H3,(H,18,19)
InChIKeyWKUCHBGDOUVQPM-UHFFFAOYSA-N
XLogP3.79
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-Methyl-2-phenyl-1,3-thiazol-5-yl)ethan-1-one
CID 540397
4-Methyl-2-Phenyl-1,3-Thiazole-5-Carboxamide
CID 737887
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 16032033
N-(cyanomethyl)-4-methyl-2-(2-phenyl-1,3-thiazol-4-yl)pentanamide
CID 11034349
N-{2-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}thiophene-2-carboxamide
CID 7207745
N'5-(2-methylbut-2-enoyl)-4-methyl-2-phenyl-1,3-thiazole-5-carbohydrazide
CID 5703420
3,3-dimethyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 7152314
N-(2,4-dimethylphenyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 8076096
N-(2-fluorophenyl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 23610162
2,4-dimethyl-N-(3-methylphenyl)-1,3-thiazole-5-carboxamide
CID 695122
N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 1483672
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]acetamide
CID 3244200

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide (CID 9123866) is N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide is Cc1nc(-c2ccccc2)sc1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide?
The InChIKey is WKUCHBGDOUVQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c1-11-14(15(19)18-13-9-5-6-10-13)20-16(17-11)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-10H2,1H3,(H,18,19).
What are the key properties of N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide?
N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide has a molecular weight of 286.40 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 9123866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).