2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one

C15H22N2O2 — CID 112685654

IUPAC2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
SMILESCOC(C)C(=O)N1CCN(C)CC1c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-12(19-3)15(18)17-10-9-16(2)11-14(17)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3
InChIKeyFWWPLPKAEYOJRF-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.54
Rot. Bonds3

About 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one

2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one (PubChem CID 112685654) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one.

Molecular Properties

Compound Name2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
PubChem CID112685654
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
SMILESCOC(C)C(=O)N1CCN(C)CC1c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-12(19-3)15(18)17-10-9-16(2)11-14(17)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3
InChIKeyFWWPLPKAEYOJRF-UHFFFAOYSA-N
XLogP1.54
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-1-(4-methyl-2-phenylpiperazin-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

(2S)-2-(4-methoxyphenoxy)-1-[(2S)-4-methyl-2-phenylpiperazin-1-yl]propan-1-one
CID 51929991
(2R)-2-amino-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
CID 54991398
3-amino-2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
CID 106110999
2-(4-chlorophenoxy)-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one
CID 55394367
(2S)-1-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-2-phenylsulfanylpropan-1-one
CID 129376778
2-bromo-1-(4-methyl-2-phenylpiperazin-1-yl)butan-1-one
CID 62856286
2-[(4-methyl-2-phenylpiperazine-1-carbonyl)amino]propanoic acid
CID 61181654
N-[(2S)-1-[(2S)-4-methyl-2-phenylpiperazin-1-yl]-1-oxopropan-2-yl]-2-phenoxyacetamide
CID 37332784
(E)-3-(4-methoxyphenyl)-N-[(2S)-1-[(2S)-4-methyl-2-phenylpiperazin-1-yl]-1-oxopropan-2-yl]prop-2-enamide
CID 30665525
N-(2-chloropropanoyl)-4-methyl-2-phenylpiperazine-1-carboxamide
CID 43328757
(4-methyl-2-phenylpiperazin-1-yl)-phenylmethanone
CID 4069484
4-bromo-N-[(2S)-1-[(2R)-4-methyl-2-phenylpiperazin-1-yl]-1-oxopropan-2-yl]benzamide
CID 129376775

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one?
The IUPAC name of 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one (CID 112685654) is 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one.
What is the SMILES notation for 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one?
The canonical SMILES for 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one is COC(C)C(=O)N1CCN(C)CC1c1ccccc1.
What is the InChIKey of 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one?
The InChIKey is FWWPLPKAEYOJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12(19-3)15(18)17-10-9-16(2)11-14(17)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3.
What are the key properties of 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one?
2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one has a molecular weight of 262.35 g/mol, XLogP of 1.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(4-methyl-2-phenylpiperazin-1-yl)propan-1-one is sourced from PubChem (CID 112685654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).