[4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine

C15H17ClN2S — CID 82106729

IUPAC[4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine
SMILESNCc1nc(-c2ccc(Cl)cc2)c(C2CCCC2)s1
InChIInChI=1S/C15H17ClN2S/c16-12-7-5-10(6-8-12)14-15(11-3-1-2-4-11)19-13(9-17)18-14/h5-8,11H,1-4,9,17H2
InChIKeyCKPIAMAZQNBMJY-UHFFFAOYSA-N
MW292.83 g/mol
LogP4.58
Rot. Bonds3

About [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine

[4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine (PubChem CID 82106729) has the molecular formula C15H17ClN2S and a molecular weight of 292.83 g/mol. Its IUPAC name is [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine
PubChem CID82106729
Molecular FormulaC15H17ClN2S
Molecular Weight292.83 g/mol
Exact Mass292.08
IUPAC Name[4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine
SMILESNCc1nc(-c2ccc(Cl)cc2)c(C2CCCC2)s1
InChIInChI=1S/C15H17ClN2S/c16-12-7-5-10(6-8-12)14-15(11-3-1-2-4-11)19-13(9-17)18-14/h5-8,11H,1-4,9,17H2
InChIKeyCKPIAMAZQNBMJY-UHFFFAOYSA-N
XLogP4.58
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.83
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine 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

(5-cyclopentyl-4-pyridin-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106833
2-[5-cyclopentyl-4-(3-methylphenyl)-1,3-thiazol-2-yl]ethanamine
CID 82106625
5-cyclohexyl-4-(4-methylphenyl)-1,3-thiazol-2-amine
CID 82106576
5-cyclohexyl-4-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 82106632
2-chloro-5-cyclopentyl-4-[4-(difluoromethoxy)phenyl]-1,3-thiazole
CID 167489489
[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methanamine
CID 3299475
5-(4-chlorophenyl)-2-cyclohexyl-3-ethylimidazol-4-amine
CID 63468570
4-[4-(4-chlorophenyl)-2-[(2-oxocyclopentyl)methyl]-1,3-thiazol-5-yl]benzenesulfonamide
CID 75204334
2-[4-(4-chlorophenyl)-2-ethyl-1,3-thiazol-5-yl]ethanamine
CID 82069519
[5-(4-cyclohexylphenyl)-1,3,4-thiadiazol-2-yl]methanamine
CID 82360101
2-(2-aminoethyl)-4-(4-chlorophenyl)-1,3-thiazole-5-carbonitrile
CID 82486195
4-(4-bromophenyl)-5-cyclopropyl-1,3-thiazol-2-amine
CID 156849994

Frequently Asked Questions

What is the IUPAC name of [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine?
The IUPAC name of [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine (CID 82106729) is [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine.
What is the SMILES notation for [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine?
The canonical SMILES for [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine is NCc1nc(-c2ccc(Cl)cc2)c(C2CCCC2)s1.
What is the InChIKey of [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine?
The InChIKey is CKPIAMAZQNBMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2S/c16-12-7-5-10(6-8-12)14-15(11-3-1-2-4-11)19-13(9-17)18-14/h5-8,11H,1-4,9,17H2.
What are the key properties of [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine?
[4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine has a molecular weight of 292.83 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-chlorophenyl)-5-cyclopentyl-1,3-thiazol-2-yl]methanamine is sourced from PubChem (CID 82106729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).