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

C18H23N3OS — CID 90597351

IUPAC4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide
SMILESO=C(CCCc1ccccc1)NC1CCN(c2nccs2)CC1
InChIInChI=1S/C18H23N3OS/c22-17(8-4-7-15-5-2-1-3-6-15)20-16-9-12-21(13-10-16)18-19-11-14-23-18/h1-3,5-6,11,14,16H,4,7-10,12-13H2,(H,20,22)
InChIKeyIANUYBKESMGMAC-UHFFFAOYSA-N
MW329.47 g/mol
LogP3.25
Rot. Bonds6

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

4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide (PubChem CID 90597351) has the molecular formula C18H23N3OS and a molecular weight of 329.47 g/mol. Its IUPAC name is 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide.

Molecular Properties

Compound Name4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide
PubChem CID90597351
Molecular FormulaC18H23N3OS
Molecular Weight329.47 g/mol
Exact Mass329.16
IUPAC Name4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide
SMILESO=C(CCCc1ccccc1)NC1CCN(c2nccs2)CC1
InChIInChI=1S/C18H23N3OS/c22-17(8-4-7-15-5-2-1-3-6-15)20-16-9-12-21(13-10-16)18-19-11-14-23-18/h1-3,5-6,11,14,16H,4,7-10,12-13H2,(H,20,22)
InChIKeyIANUYBKESMGMAC-UHFFFAOYSA-N
XLogP3.25
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.47
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

3-(3-methylthiophen-2-yl)-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]propanamide
CID 90597292
N-[1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]pentanamide
CID 121144562
N-(1-methylpiperidin-4-yl)-4-phenylbutanamide
CID 2971184
3-(4-chloro-3-methylphenyl)-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]propanamide
CID 90597302
2-(2-methylphenoxy)-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]acetamide
CID 90597199
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]benzamide
CID 90597412
N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]furan-2-carboxamide
CID 73168320
N-(1-ethylpiperidin-4-yl)-4-phenylbutanamide
CID 17250229
3-[4-chloro-3-(trifluoromethyl)phenyl]-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]propanamide
CID 71810033
4-(4-methylphenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)butanamide
CID 47047200
N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 29439867
2-phenyl-N-[(3S)-1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]ethanesulfonamide
CID 99875511

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide?
The IUPAC name of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide (CID 90597351) is 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide.
What is the SMILES notation for 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide?
The canonical SMILES for 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide is O=C(CCCc1ccccc1)NC1CCN(c2nccs2)CC1.
What is the InChIKey of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide?
The InChIKey is IANUYBKESMGMAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3OS/c22-17(8-4-7-15-5-2-1-3-6-15)20-16-9-12-21(13-10-16)18-19-11-14-23-18/h1-3,5-6,11,14,16H,4,7-10,12-13H2,(H,20,22).
What are the key properties of 4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide?
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide has a molecular weight of 329.47 g/mol, XLogP of 3.25, 6 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]butanamide is sourced from PubChem (CID 90597351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).