4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide

C22H24N4O2 — CID 24528636

IUPAC4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
SMILESCc1cc(NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)no1
InChIInChI=1S/C22H24N4O2/c1-17-16-20(24-28-17)23-22(27)26-14-12-25(13-15-26)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,16,21H,12-15H2,1H3,(H,23,24,27)
InChIKeyDTDQSFDGNADBOR-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.92
Rot. Bonds4

About 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide

4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide (PubChem CID 24528636) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
PubChem CID24528636
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
SMILESCc1cc(NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)no1
InChIInChI=1S/C22H24N4O2/c1-17-16-20(24-28-17)23-22(27)26-14-12-25(13-15-26)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,16,21H,12-15H2,1H3,(H,23,24,27)
InChIKeyDTDQSFDGNADBOR-UHFFFAOYSA-N
XLogP3.92
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide 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

2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 43002731
4-[(R)-hydroxy(phenyl)methyl]-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carboxamide
CID 30598601
(2S)-2-(4-acetylpiperazin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 34680281
4-benzhydryl-N-[4-[(4-benzhydrylpiperazine-1-carbonyl)amino]phenyl]piperazine-1-carboxamide
CID 43834011
N-(5-methyl-1,2-oxazol-3-yl)-4-(2-methyl-6-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113112562
N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide
CID 166184100
N-(3-acetylphenyl)-4-benzhydrylpiperazine-1-carboxamide
CID 2955113
4-benzhydryl-N-(2-hydroxyphenyl)piperazine-1-carboxamide
CID 108871381
4-(3,5-dimethylphenyl)-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113111781
4-(4-chlorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 113112990
4-benzhydryl-N-(2,4,6-trifluorophenyl)piperazine-1-carboxamide
CID 46100869
N-(2-fluoro-5-methylphenyl)-4-[(R)-(4-methylphenyl)-phenylmethyl]piperazine-1-carboxamide
CID 92768345

Frequently Asked Questions

What is the IUPAC name of 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide?
The IUPAC name of 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide (CID 24528636) is 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide is Cc1cc(NC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)no1.
What is the InChIKey of 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide?
The InChIKey is DTDQSFDGNADBOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-17-16-20(24-28-17)23-22(27)26-14-12-25(13-15-26)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,16,21H,12-15H2,1H3,(H,23,24,27).
What are the key properties of 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide?
4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzhydryl-N-(5-methyl-1,2-oxazol-3-yl)piperazine-1-carboxamide is sourced from PubChem (CID 24528636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).