5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine

C17H27N3 — CID 64936382

IUPAC5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine
SMILESCC1CN(C2CCCN(C)C2)C(c2ccccc2)CN1
InChIInChI=1S/C17H27N3/c1-14-12-20(16-9-6-10-19(2)13-16)17(11-18-14)15-7-4-3-5-8-15/h3-5,7-8,14,16-18H,6,9-13H2,1-2H3
InChIKeyXLAQOGSEGPKNAC-UHFFFAOYSA-N
MW273.42 g/mol
LogP2.12
Rot. Bonds2

About 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine

5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine (PubChem CID 64936382) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine.

Molecular Properties

Compound Name5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine
PubChem CID64936382
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC Name5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine
SMILESCC1CN(C2CCCN(C)C2)C(c2ccccc2)CN1
InChIInChI=1S/C17H27N3/c1-14-12-20(16-9-6-10-19(2)13-16)17(11-18-14)15-7-4-3-5-8-15/h3-5,7-8,14,16-18H,6,9-13H2,1-2H3
InChIKeyXLAQOGSEGPKNAC-UHFFFAOYSA-N
XLogP2.12
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine 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

1-cyclopropyl-5-methyl-2-phenylpiperazine
CID 64954274
5-methyl-1-(4-methylcyclohexyl)-2-phenylpiperazine
CID 64954698
1-(3-methoxycyclohexyl)-5-methyl-2-phenylpiperazine
CID 64844557
2,5-dimethyl-1-(1-methylpiperidin-3-yl)piperazine
CID 64936770
5-tert-butyl-1-cyclobutyl-2-phenylpiperazine
CID 64947167
(3R,4R)-1,3-dimethyl-4-phenylazepane
CID 125480807
5-methyl-1-(1-methylcyclobutyl)-2-phenylpiperazine
CID 113486045
(2S,5R)-1-benzyl-5-methyl-2-phenylpiperazine
CID 86680328
5-ethyl-3-(1-methylpiperidin-3-yl)-2-phenylimidazolidin-4-one
CID 83247325
1-cyclobutyl-2-phenylpiperazine
CID 64931514
5-methyl-1-octyl-2-phenylpiperazine
CID 64845541
1-heptyl-5-methyl-2-phenylpiperazine
CID 64846339

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine?
The IUPAC name of 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine (CID 64936382) is 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine.
What is the SMILES notation for 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine?
The canonical SMILES for 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine is CC1CN(C2CCCN(C)C2)C(c2ccccc2)CN1.
What is the InChIKey of 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine?
The InChIKey is XLAQOGSEGPKNAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-14-12-20(16-9-6-10-19(2)13-16)17(11-18-14)15-7-4-3-5-8-15/h3-5,7-8,14,16-18H,6,9-13H2,1-2H3.
What are the key properties of 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine?
5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine has a molecular weight of 273.42 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(1-methylpiperidin-3-yl)-2-phenylpiperazine is sourced from PubChem (CID 64936382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).