2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone

C24H30N2O2 — CID 55583808

IUPAC2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone
SMILESO=C(COC(c1ccccc1)c1ccccc1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C24H30N2O2/c27-23(26-17-15-25(16-18-26)22-13-7-8-14-22)19-28-24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,22,24H,7-8,13-19H2
InChIKeyRPCFRIGHFGRQHA-UHFFFAOYSA-N
MW378.52 g/mol
LogP3.88
Rot. Bonds6

About 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone

2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone (PubChem CID 55583808) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone
PubChem CID55583808
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC Name2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone
SMILESO=C(COC(c1ccccc1)c1ccccc1)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C24H30N2O2/c27-23(26-17-15-25(16-18-26)22-13-7-8-14-22)19-28-24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,22,24H,7-8,13-19H2
InChIKeyRPCFRIGHFGRQHA-UHFFFAOYSA-N
XLogP3.88
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone 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-benzhydryloxy-1-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethanone
CID 36512164
2-(4-benzhydrylpiperazin-1-yl)-1-(4-cyclopentylpiperazin-1-yl)ethanone
CID 57442367
1-(4-cyclopentylpiperazin-1-yl)-4-phenoxybutan-1-one
CID 110741288
1-(4-cyclopentylpiperazin-1-yl)-2-hydroxy-2-phenylethanone
CID 111432279
1-(4-cyclopentylpiperazin-1-yl)-2-naphthalen-2-yloxyethanone;oxalic acid
CID 2880120
1-(4-cyclopentylpiperazin-1-yl)-2-phenylpentan-1-one
CID 55584335
3-(2-bromophenyl)sulfanyl-1-(4-cyclopentylpiperazin-1-yl)propan-1-one
CID 55712713
bis((Z)-but-2-enedioic acid);1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-cyclohexylpiperazine
CID 6436584
1-(4-cyclopentylpiperazin-1-yl)-2-(4-ethoxyphenoxy)ethanone
CID 134020442
1-(4-cyclopentylpiperazin-1-yl)-2-(4-methoxyphenoxy)ethanone;oxalic acid
CID 2878195
1-(4-cyclopentylpiperazin-1-yl)-2-(2-nitrophenoxy)ethanone
CID 134020517
1-(4-cyclopropylpiperazin-1-yl)-3-phenylpropan-1-one
CID 110708530

Frequently Asked Questions

What is the IUPAC name of 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone?
The IUPAC name of 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone (CID 55583808) is 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone is O=C(COC(c1ccccc1)c1ccccc1)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone?
The InChIKey is RPCFRIGHFGRQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c27-23(26-17-15-25(16-18-26)22-13-7-8-14-22)19-28-24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,22,24H,7-8,13-19H2.
What are the key properties of 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone?
2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone has a molecular weight of 378.52 g/mol, XLogP of 3.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone is sourced from PubChem (CID 55583808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).