(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one

C22H26N2O2 — CID 94855656

IUPAC(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one
SMILESC[C@@H](C(=O)N1CCN(C(=O)[C@H](C)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c1-17(19-9-5-3-6-10-19)21(25)23-13-15-24(16-14-23)22(26)18(2)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3/t17-,18-/m1/s1
InChIKeyCUAYAOIHXYFWMO-QZTJIDSGSA-N
MW350.46 g/mol
LogP3.26
Rot. Bonds4

About (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one

(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one (PubChem CID 94855656) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one.

Molecular Properties

Compound Name(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one
PubChem CID94855656
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one
SMILESC[C@@H](C(=O)N1CCN(C(=O)[C@H](C)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c1-17(19-9-5-3-6-10-19)21(25)23-13-15-24(16-14-23)22(26)18(2)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3/t17-,18-/m1/s1
InChIKeyCUAYAOIHXYFWMO-QZTJIDSGSA-N
XLogP3.26
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one 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-(2-phenylpropanoyl)piperazine-1-carboxylic acid
CID 123978290
2-phenyl-1-piperazin-1-ylpropan-1-one
CID 52983882
1-(4-benzylpiperazin-1-yl)-2-phenylpropan-1-one
CID 71304914
2-phenyl-1-(4-pyrazin-2-ylpiperazin-1-yl)propan-1-one
CID 71322934
1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one
CID 119034196
(2R)-2-phenyl-1-[4-[(2S)-1,1,1-trifluoro-2-hydroxypropan-2-yl]piperidin-1-yl]propan-1-one
CID 99855905
5-methyl-1-[(2S)-2-phenylpropanoyl]piperidine-3-carboxylic acid
CID 122117477
3-methyl-1-(4-methylpiperazin-1-yl)-2-phenylbutan-1-one
CID 3151806
N-benzyl-1-(2-phenylpropanoyl)piperidine-4-carboxamide
CID 11035504
2-phenyl-1-[4-(5-phenyl-1H-pyrazol-3-yl)-1,4-diazepan-1-yl]propan-1-one
CID 91904652
1-[4-(2,2-diphenylacetyl)-1,4-diazepan-1-yl]-2,2-diphenylethanone
CID 5069183
1-(4-methylpiperazin-1-yl)-2-pyridin-3-ylpropan-1-one
CID 18715054

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one?
The IUPAC name of (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one (CID 94855656) is (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one.
What is the SMILES notation for (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one?
The canonical SMILES for (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one is C[C@@H](C(=O)N1CCN(C(=O)[C@H](C)c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one?
The InChIKey is CUAYAOIHXYFWMO-QZTJIDSGSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-17(19-9-5-3-6-10-19)21(25)23-13-15-24(16-14-23)22(26)18(2)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3/t17-,18-/m1/s1.
What are the key properties of (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one?
(2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one has a molecular weight of 350.46 g/mol, XLogP of 3.26, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-1-[4-[(2R)-2-phenylpropanoyl]piperazin-1-yl]propan-1-one is sourced from PubChem (CID 94855656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).