2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine

C15H22N4 — CID 115238261

IUPAC2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine
SMILESCc1[nH]c2ccccc2c1NCC1CNCCN1C
InChIInChI=1S/C15H22N4/c1-11-15(13-5-3-4-6-14(13)18-11)17-10-12-9-16-7-8-19(12)2/h3-6,12,16-18H,7-10H2,1-2H3
InChIKeyFVLIWUINPUCXNP-UHFFFAOYSA-N
MW258.37 g/mol
LogP1.79
Rot. Bonds3

About 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine

2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine (PubChem CID 115238261) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine
PubChem CID115238261
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine
SMILESCc1[nH]c2ccccc2c1NCC1CNCCN1C
InChIInChI=1S/C15H22N4/c1-11-15(13-5-3-4-6-14(13)18-11)17-10-12-9-16-7-8-19(12)2/h3-6,12,16-18H,7-10H2,1-2H3
InChIKeyFVLIWUINPUCXNP-UHFFFAOYSA-N
XLogP1.79
TPSA43.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine?
The IUPAC name of 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine (CID 115238261) is 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine.
What is the SMILES notation for 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine?
The canonical SMILES for 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine is Cc1[nH]c2ccccc2c1NCC1CNCCN1C.
What is the InChIKey of 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine?
The InChIKey is FVLIWUINPUCXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-11-15(13-5-3-4-6-14(13)18-11)17-10-12-9-16-7-8-19(12)2/h3-6,12,16-18H,7-10H2,1-2H3.
What are the key properties of 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine?
2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine has a molecular weight of 258.37 g/mol, XLogP of 1.79, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-methylpiperazin-2-yl)methyl]-1H-indol-3-amine is sourced from PubChem (CID 115238261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).