4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide

C21H21N3OS — CID 90597412

IUPAC4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(c2nccs2)CC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H21N3OS/c25-20(18-8-6-17(7-9-18)16-4-2-1-3-5-16)23-19-10-13-24(14-11-19)21-22-12-15-26-21/h1-9,12,15,19H,10-11,13-14H2,(H,23,25)
InChIKeyPDUHWKDTJSPPGM-UHFFFAOYSA-N
MW363.49 g/mol
LogP4.21
Rot. Bonds4

About 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide

4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide (PubChem CID 90597412) has the molecular formula C21H21N3OS and a molecular weight of 363.49 g/mol. Its IUPAC name is 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
PubChem CID90597412
Molecular FormulaC21H21N3OS
Molecular Weight363.49 g/mol
Exact Mass363.14
IUPAC Name4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(c2nccs2)CC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H21N3OS/c25-20(18-8-6-17(7-9-18)16-4-2-1-3-5-16)23-19-10-13-24(14-11-19)21-22-12-15-26-21/h1-9,12,15,19H,10-11,13-14H2,(H,23,25)
InChIKeyPDUHWKDTJSPPGM-UHFFFAOYSA-N
XLogP4.21
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.49
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide 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

4-butoxy-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
CID 90597226
4-chloro-N-[1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]benzamide
CID 121144583
3,4-dimethoxy-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
CID 90597214
2-methylsulfanyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
CID 90597201
N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]furan-2-carboxamide
CID 73168320
1-methyl-3-(4-phenylphenyl)-1-[1-(1,3-thiazol-2-yl)piperidin-4-yl]urea
CID 20782294
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide
CID 90597351
4-oxo-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-3H-phthalazine-1-carboxamide
CID 138992263
4-propan-2-yloxy-N-[(3R)-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]benzamide
CID 99875296
N-(1-cyclopropylpiperidin-4-yl)-4-phenylbenzamide
CID 26131227
1-phenyl-3-[(3R)-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]urea
CID 99875460
4-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]thiophene-2-carboxamide
CID 90597173

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide?
The IUPAC name of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide (CID 90597412) is 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide.
What is the SMILES notation for 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide?
The canonical SMILES for 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide is O=C(NC1CCN(c2nccs2)CC1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide?
The InChIKey is PDUHWKDTJSPPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3OS/c25-20(18-8-6-17(7-9-18)16-4-2-1-3-5-16)23-19-10-13-24(14-11-19)21-22-12-15-26-21/h1-9,12,15,19H,10-11,13-14H2,(H,23,25).
What are the key properties of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide?
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide has a molecular weight of 363.49 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide is sourced from PubChem (CID 90597412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).