[4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone

C20H24N2O3 — CID 71944477

IUPAC[4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone
SMILESO=C(c1cccc(OCc2ccccc2)c1)N1CCN(CCO)CC1
InChIInChI=1S/C20H24N2O3/c23-14-13-21-9-11-22(12-10-21)20(24)18-7-4-8-19(15-18)25-16-17-5-2-1-3-6-17/h1-8,15,23H,9-14,16H2
InChIKeyJRIDKWYMIOPUSV-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.02
Rot. Bonds6

About [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone

[4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone (PubChem CID 71944477) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone.

Molecular Properties

Compound Name[4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone
PubChem CID71944477
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name[4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone
SMILESO=C(c1cccc(OCc2ccccc2)c1)N1CCN(CCO)CC1
InChIInChI=1S/C20H24N2O3/c23-14-13-21-9-11-22(12-10-21)20(24)18-7-4-8-19(15-18)25-16-17-5-2-1-3-6-17/h1-8,15,23H,9-14,16H2
InChIKeyJRIDKWYMIOPUSV-UHFFFAOYSA-N
XLogP2.02
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone 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-dimethylazetidin-1-yl)-(3-phenylmethoxyphenyl)methanone
CID 155462351
(4-benzylpiperazin-1-yl)-[3-[(3-bromophenoxy)methyl]phenyl]methanone
CID 19289234
1-[4-[4-(3-phenylmethoxybenzoyl)piperazin-1-yl]phenyl]ethanone
CID 8004468
(3,3-difluoroazetidin-1-yl)-(3-phenylmethoxyphenyl)methanone
CID 155462347
(4-cyclobutyl-1,4-diazepan-1-yl)-(3-phenylmethoxyphenyl)methanone
CID 11175983
[4-[3-(2-phenoxyethoxy)benzoyl]piperazin-1-yl]-[3-(2-phenoxyethoxy)phenyl]methanone
CID 4955546
[3-[(4-fluorophenyl)methoxy]phenyl]-[4-(2-methylsulfonylethyl)piperazin-1-yl]methanone
CID 56572417
[4-(2-ethoxyphenyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone
CID 9415526
[4-(2-hydroxyethyl)piperazin-1-yl]-naphthalen-2-ylmethanone
CID 43390847
[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(3-phenylmethoxyphenyl)methanone
CID 17449026
1-[4-[3-[(3-methylphenyl)methoxy]benzoyl]piperazin-1-yl]ethanone
CID 34840464
(4-benzylpiperazin-1-yl)-[3-(2,2,2-trifluoroethoxy)phenyl]methanone
CID 19290787

Frequently Asked Questions

What is the IUPAC name of [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone?
The IUPAC name of [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone (CID 71944477) is [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone.
What is the SMILES notation for [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone?
The canonical SMILES for [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone is O=C(c1cccc(OCc2ccccc2)c1)N1CCN(CCO)CC1.
What is the InChIKey of [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone?
The InChIKey is JRIDKWYMIOPUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c23-14-13-21-9-11-22(12-10-21)20(24)18-7-4-8-19(15-18)25-16-17-5-2-1-3-6-17/h1-8,15,23H,9-14,16H2.
What are the key properties of [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone?
[4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone has a molecular weight of 340.42 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-hydroxyethyl)piperazin-1-yl]-(3-phenylmethoxyphenyl)methanone is sourced from PubChem (CID 71944477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).