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

C15H17N3OS — CID 53335704

IUPAC4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide
SMILESNc1c(-c2ccccc2)nsc1C(=O)NC1CCCC1
InChIInChI=1S/C15H17N3OS/c16-12-13(10-6-2-1-3-7-10)18-20-14(12)15(19)17-11-8-4-5-9-11/h1-3,6-7,11H,4-5,8-9,16H2,(H,17,19)
InChIKeyNJJSJCRPLCPOFC-UHFFFAOYSA-N
MW287.39 g/mol
LogP3.06
Rot. Bonds3

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

4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide (PubChem CID 53335704) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide
PubChem CID53335704
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide
SMILESNc1c(-c2ccccc2)nsc1C(=O)NC1CCCC1
InChIInChI=1S/C15H17N3OS/c16-12-13(10-6-2-1-3-7-10)18-20-14(12)15(19)17-11-8-4-5-9-11/h1-3,6-7,11H,4-5,8-9,16H2,(H,17,19)
InChIKeyNJJSJCRPLCPOFC-UHFFFAOYSA-N
XLogP3.06
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-cyclooctyl-4-phenyl-1,3-thiazole-5-carboxamide
CID 39071425
4-amino-3-N-[(2-chlorophenyl)methyl]-5-N-cycloheptyl-1,2-thiazole-3,5-dicarboxamide
CID 53331408
4-amino-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-thiazole-5-carboxamide
CID 53335695
4-amino-N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2-fluorophenyl)-3-(4-methoxyphenyl)-1,2-thiazole-5-carboxamide
CID 3192704
N-cyclohexyl-5,6-diphenylpyrazine-2-carboxamide
CID 10150172
4-amino-N-[(1R)-2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1,2-thiazole-5-carboxamide
CID 98099556
N-(4-aminocyclohexyl)-2,4-diphenyl-1,3-thiazole-5-carboxamide
CID 119477493
N-cyclooctyl-3-methyl-2-phenylquinoline-4-carboxamide
CID 4122728
N-cyclohexyl-2,4-diphenyl-1,3-oxazole-5-carboxamide
CID 15090685
4-amino-N-[(1R)-2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-3-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]-1,2-thiazole-5-carboxamide
CID 98099610
4-amino-3-N-cyclohexyl-5-N-[(2R)-1-(cyclopentylamino)-1-oxobutan-2-yl]-5-N-phenyl-1,2-thiazole-3,5-dicarboxamide
CID 1156229
4-amino-N-[(1R)-2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-3-(4-fluorophenyl)-1,2-thiazole-5-carboxamide
CID 98099649

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide?
The IUPAC name of 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide (CID 53335704) is 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide is Nc1c(-c2ccccc2)nsc1C(=O)NC1CCCC1.
What is the InChIKey of 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide?
The InChIKey is NJJSJCRPLCPOFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c16-12-13(10-6-2-1-3-7-10)18-20-14(12)15(19)17-11-8-4-5-9-11/h1-3,6-7,11H,4-5,8-9,16H2,(H,17,19).
What are the key properties of 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide?
4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide has a molecular weight of 287.39 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopentyl-3-phenyl-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 53335704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).