N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide

C22H27N3O2 — CID 124816393

IUPACN-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide
SMILESC[C@H](CC(=O)N1CCN(C)C[C@H]1c1ccccc1)NC(=O)c1ccccc1
InChIInChI=1S/C22H27N3O2/c1-17(23-22(27)19-11-7-4-8-12-19)15-21(26)25-14-13-24(2)16-20(25)18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3,(H,23,27)/t17-,20+/m1/s1
InChIKeyIJKUOAMMHWESON-XLIONFOSSA-N
MW365.48 g/mol
LogP2.71
Rot. Bonds5

About N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide

N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide (PubChem CID 124816393) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide.

Molecular Properties

Compound NameN-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide
PubChem CID124816393
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide
SMILESC[C@H](CC(=O)N1CCN(C)C[C@H]1c1ccccc1)NC(=O)c1ccccc1
InChIInChI=1S/C22H27N3O2/c1-17(23-22(27)19-11-7-4-8-12-19)15-21(26)25-14-13-24(2)16-20(25)18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3,(H,23,27)/t17-,20+/m1/s1
InChIKeyIJKUOAMMHWESON-XLIONFOSSA-N
XLogP2.71
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide 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-bromo-N-[(2S)-1-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-1-oxopropan-2-yl]benzamide
CID 129376775
1-[(2S)-4-methyl-2-phenylpiperazin-1-yl]-4-phenylbutane-1,4-dione
CID 51926961
N-[4-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-4-oxobutan-2-yl]benzamide
CID 46635876
(4-methyl-2-phenylpiperazin-1-yl)-phenylmethanone
CID 4069484
N-[3-(4-methyl-2-phenylpiperazin-1-yl)-3-oxo-1-thiophen-2-ylpropyl]acetamide
CID 42931938
2-[(4-methyl-2-phenylpiperazine-1-carbonyl)amino]propanoic acid
CID 61181654
N-[1-(4-fluorophenyl)-3-(4-methyl-2-phenylpiperazin-1-yl)-3-oxopropyl]acetamide
CID 46957784
N-[1-(4-chlorophenyl)-3-(4-methyl-2-phenylpiperazin-1-yl)-3-oxopropyl]acetamide
CID 42931935
5-amino-1-(4-methyl-2-phenylpiperazin-1-yl)hexan-1-one
CID 82846107
3-methyl-N-[2-(4-methyl-2-phenylpiperazin-1-yl)-2-oxoethyl]benzamide
CID 51251955
[(1R)-1-(2-chlorophenyl)-3-[(2S)-4-methyl-2-phenylpiperazin-1-yl]-3-oxopropyl]urea
CID 98684646
2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
CID 112685654

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide?
The IUPAC name of N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide (CID 124816393) is N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide.
What is the SMILES notation for N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide?
The canonical SMILES for N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide is C[C@H](CC(=O)N1CCN(C)C[C@H]1c1ccccc1)NC(=O)c1ccccc1.
What is the InChIKey of N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide?
The InChIKey is IJKUOAMMHWESON-XLIONFOSSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-17(23-22(27)19-11-7-4-8-12-19)15-21(26)25-14-13-24(2)16-20(25)18-9-5-3-6-10-18/h3-12,17,20H,13-16H2,1-2H3,(H,23,27)/t17-,20+/m1/s1.
What are the key properties of N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide?
N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide has a molecular weight of 365.48 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-4-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-4-oxobutan-2-yl]benzamide is sourced from PubChem (CID 124816393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).