1-[(4-methylpiperazin-1-yl)methyl]indole

C14H19N3 — CID 15851967

IUPAC1-[(4-methylpiperazin-1-yl)methyl]indole
SMILESCN1CCN(Cn2ccc3ccccc32)CC1
InChIInChI=1S/C14H19N3/c1-15-8-10-16(11-9-15)12-17-7-6-13-4-2-3-5-14(13)17/h2-7H,8-12H2,1H3
InChIKeyJIFDEFRYXOCNOI-UHFFFAOYSA-N
MW229.33 g/mol
LogP1.85
Rot. Bonds2

About 1-[(4-methylpiperazin-1-yl)methyl]indole

1-[(4-methylpiperazin-1-yl)methyl]indole (PubChem CID 15851967) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-[(4-methylpiperazin-1-yl)methyl]indole.

Molecular Properties

Compound Name1-[(4-methylpiperazin-1-yl)methyl]indole
PubChem CID15851967
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-[(4-methylpiperazin-1-yl)methyl]indole
SMILESCN1CCN(Cn2ccc3ccccc32)CC1
InChIInChI=1S/C14H19N3/c1-15-8-10-16(11-9-15)12-17-7-6-13-4-2-3-5-14(13)17/h2-7H,8-12H2,1H3
InChIKeyJIFDEFRYXOCNOI-UHFFFAOYSA-N
XLogP1.85
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[(4-methylpiperazin-1-yl)methyl]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

1-[(4-ethylpiperazin-1-yl)methyl]indole
CID 142782259
1-[3-(4-methylpiperazin-1-yl)propyl]indole
CID 3018029
1-[[4-(5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]methyl]indole
CID 175814165
(1R,2S)-1-indol-1-yl-3-(4-methylpiperazin-1-yl)-1-phenylpropan-2-ol
CID 59771315
(1S,2S)-1-indol-1-yl-3-(4-methylpiperazin-1-yl)-1-phenylpropan-2-ol
CID 45486546
1-(3-indol-1-ylpropyl)-2-methyl-3-[4-(4-methylpiperazin-1-yl)butyl]guanidine;hydroiodide
CID 111341528
1-ethylindole;propane
CID 91144409
N-(3-indol-1-ylpropyl)-1-methylpiperidin-4-amine
CID 28716039
1-[[3,5-bis(indol-1-ylmethyl)-2,4,6-trimethylphenyl]methyl]indole
CID 102177432
1-[(4-methylpiperazin-1-yl)methyl]indole-3-carbaldehyde
CID 82164234
1-(3-indol-1-ylpropyl)-2-methyl-3-[2-(4-methyl-1,4-diazepan-1-yl)ethyl]guanidine
CID 111341971
1-(2-fluoroethyl)indole
CID 80694500

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methylpiperazin-1-yl)methyl]indole?
The IUPAC name of 1-[(4-methylpiperazin-1-yl)methyl]indole (CID 15851967) is 1-[(4-methylpiperazin-1-yl)methyl]indole.
What is the SMILES notation for 1-[(4-methylpiperazin-1-yl)methyl]indole?
The canonical SMILES for 1-[(4-methylpiperazin-1-yl)methyl]indole is CN1CCN(Cn2ccc3ccccc32)CC1.
What is the InChIKey of 1-[(4-methylpiperazin-1-yl)methyl]indole?
The InChIKey is JIFDEFRYXOCNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-15-8-10-16(11-9-15)12-17-7-6-13-4-2-3-5-14(13)17/h2-7H,8-12H2,1H3.
What are the key properties of 1-[(4-methylpiperazin-1-yl)methyl]indole?
1-[(4-methylpiperazin-1-yl)methyl]indole has a molecular weight of 229.33 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methylpiperazin-1-yl)methyl]indole is sourced from PubChem (CID 15851967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).