4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide

C23H24N2OS — CID 142279944

IUPAC4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide
SMILESO=C(NCC1CCC(c2ccccc2)CC1)c1scnc1-c1ccccc1
InChIInChI=1S/C23H24N2OS/c26-23(22-21(25-16-27-22)20-9-5-2-6-10-20)24-15-17-11-13-19(14-12-17)18-7-3-1-4-8-18/h1-10,16-17,19H,11-15H2,(H,24,26)
InChIKeySVISJGPYJIMLGW-UHFFFAOYSA-N
MW376.53 g/mol
LogP5.51
Rot. Bonds5

About 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide

4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide (PubChem CID 142279944) has the molecular formula C23H24N2OS and a molecular weight of 376.53 g/mol. Its IUPAC name is 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide
PubChem CID142279944
Molecular FormulaC23H24N2OS
Molecular Weight376.53 g/mol
Exact Mass376.16
IUPAC Name4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide
SMILESO=C(NCC1CCC(c2ccccc2)CC1)c1scnc1-c1ccccc1
InChIInChI=1S/C23H24N2OS/c26-23(22-21(25-16-27-22)20-9-5-2-6-10-20)24-15-17-11-13-19(14-12-17)18-7-3-1-4-8-18/h1-10,16-17,19H,11-15H2,(H,24,26)
InChIKeySVISJGPYJIMLGW-UHFFFAOYSA-N
XLogP5.51
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.53
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 126987991
N-[(4-phenylcyclohexyl)methyl]-4-pyridin-3-yl-1H-pyrrole-3-carboxamide
CID 142280096
1-(1-hydroxypropan-2-yl)-3-[(4-phenylcyclohexyl)methyl]urea
CID 111109574
4-(4-chlorophenyl)-N-[(4-phenylcyclohexyl)methyl]-1H-pyrrole-3-carboxamide
CID 142279626
2-(3-nitro-1,2,4-triazol-1-yl)-N-[(4-phenylcyclohexyl)methyl]acetamide
CID 56783745
1-(2-hydroxyethyl)-1-methyl-3-[(4-phenylcyclohexyl)methyl]urea
CID 84593172
N-(cyclopropylmethyl)-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134798879
4-[(4-phenylcyclohexyl)methylamino]butanoic acid
CID 122035940
(2R)-2-[(4-phenylcyclohexyl)methylamino]propanoic acid
CID 122038120
2-(methanesulfonamido)-N-[(4-phenylcyclohexyl)methyl]propanamide
CID 56783962
4-[(4-phenylcyclohexyl)methylamino]cyclohexane-1-carboxylic acid
CID 122031272
4-(3-fluoro-2-methoxyphenyl)-N-[(4-phenylcyclohexyl)methyl]-1H-pyrrole-3-carboxamide
CID 142279830

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide (CID 142279944) is 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide is O=C(NCC1CCC(c2ccccc2)CC1)c1scnc1-c1ccccc1.
What is the InChIKey of 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide?
The InChIKey is SVISJGPYJIMLGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2OS/c26-23(22-21(25-16-27-22)20-9-5-2-6-10-20)24-15-17-11-13-19(14-12-17)18-7-3-1-4-8-18/h1-10,16-17,19H,11-15H2,(H,24,26).
What are the key properties of 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide?
4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide has a molecular weight of 376.53 g/mol, XLogP of 5.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[(4-phenylcyclohexyl)methyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 142279944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).