2-methylpiperazine;3-propyl-1H-indole

C16H25N3 — CID 143269934

IUPAC2-methylpiperazine;3-propyl-1H-indole
SMILESCC1CNCCN1.CCCc1c[nH]c2ccccc12
InChIInChI=1S/C11H13N.C5H12N2/c1-2-5-9-8-12-11-7-4-3-6-10(9)11;1-5-4-6-2-3-7-5/h3-4,6-8,12H,2,5H2,1H3;5-7H,2-4H2,1H3
InChIKeyCRQMTVZOMCWRDL-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.69
Rot. Bonds2

About 2-methylpiperazine;3-propyl-1H-indole

2-methylpiperazine;3-propyl-1H-indole (PubChem CID 143269934) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 2-methylpiperazine;3-propyl-1H-indole.

Molecular Properties

Compound Name2-methylpiperazine;3-propyl-1H-indole
PubChem CID143269934
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name2-methylpiperazine;3-propyl-1H-indole
SMILESCC1CNCCN1.CCCc1c[nH]c2ccccc12
InChIInChI=1S/C11H13N.C5H12N2/c1-2-5-9-8-12-11-7-4-3-6-10(9)11;1-5-4-6-2-3-7-5/h3-4,6-8,12H,2,5H2,1H3;5-7H,2-4H2,1H3
InChIKeyCRQMTVZOMCWRDL-UHFFFAOYSA-N
XLogP2.69
TPSA39.85 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-methylpiperazine;3-propyl-1H-indole 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-[[(2S)-piperazin-2-yl]methyl]-1H-indole
CID 59208274
3-(piperazin-2-ylmethyl)-1H-indole;dihydrochloride
CID 140992063
3-heptyl-1H-indole
CID 15360907
3-[4-(1H-indol-3-yl)butyl]-1H-indole
CID 57060044
3-(1H-indol-3-yl)-N-(2-methylpiperidin-4-yl)propanamide
CID 106995348
N-ethyl-2-(1H-indol-3-yl)-N-pyrrolidin-3-ylacetamide
CID 63299295
1-(1H-indol-3-yl)hexan-3-one
CID 166814803
3-(4,4-dimethylpentyl)-1H-indole
CID 58756842
3-ethyl-1H-indole;methanamine
CID 142222050
3-[(3-propylpyrrol-1-yl)methyl]-1H-indole
CID 152698267
N-[1-deuterio-2-(1H-indol-3-yl)ethyl]propan-1-amine
CID 169026501
3-(1H-indol-3-yl)propane-1,1-diol
CID 22219738

Frequently Asked Questions

What is the IUPAC name of 2-methylpiperazine;3-propyl-1H-indole?
The IUPAC name of 2-methylpiperazine;3-propyl-1H-indole (CID 143269934) is 2-methylpiperazine;3-propyl-1H-indole.
What is the SMILES notation for 2-methylpiperazine;3-propyl-1H-indole?
The canonical SMILES for 2-methylpiperazine;3-propyl-1H-indole is CC1CNCCN1.CCCc1c[nH]c2ccccc12.
What is the InChIKey of 2-methylpiperazine;3-propyl-1H-indole?
The InChIKey is CRQMTVZOMCWRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N.C5H12N2/c1-2-5-9-8-12-11-7-4-3-6-10(9)11;1-5-4-6-2-3-7-5/h3-4,6-8,12H,2,5H2,1H3;5-7H,2-4H2,1H3.
What are the key properties of 2-methylpiperazine;3-propyl-1H-indole?
2-methylpiperazine;3-propyl-1H-indole has a molecular weight of 259.40 g/mol, XLogP of 2.69, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpiperazine;3-propyl-1H-indole is sourced from PubChem (CID 143269934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).