[1-(4-methylpentyl)indol-7-yl]methanamine

C15H22N2 — CID 83169213

IUPAC[1-(4-methylpentyl)indol-7-yl]methanamine
SMILESCC(C)CCCn1ccc2cccc(CN)c21
InChIInChI=1S/C15H22N2/c1-12(2)5-4-9-17-10-8-13-6-3-7-14(11-16)15(13)17/h3,6-8,10,12H,4-5,9,11,16H2,1-2H3
InChIKeyHCVGRGVYDQDTSS-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.54
Rot. Bonds5

About [1-(4-methylpentyl)indol-7-yl]methanamine

[1-(4-methylpentyl)indol-7-yl]methanamine (PubChem CID 83169213) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is [1-(4-methylpentyl)indol-7-yl]methanamine.

Molecular Properties

Compound Name[1-(4-methylpentyl)indol-7-yl]methanamine
PubChem CID83169213
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name[1-(4-methylpentyl)indol-7-yl]methanamine
SMILESCC(C)CCCn1ccc2cccc(CN)c21
InChIInChI=1S/C15H22N2/c1-12(2)5-4-9-17-10-8-13-6-3-7-14(11-16)15(13)17/h3,6-8,10,12H,4-5,9,11,16H2,1-2H3
InChIKeyHCVGRGVYDQDTSS-UHFFFAOYSA-N
XLogP3.54
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methylpentyl)indol-7-yl]methanamine?
The IUPAC name of [1-(4-methylpentyl)indol-7-yl]methanamine (CID 83169213) is [1-(4-methylpentyl)indol-7-yl]methanamine.
What is the SMILES notation for [1-(4-methylpentyl)indol-7-yl]methanamine?
The canonical SMILES for [1-(4-methylpentyl)indol-7-yl]methanamine is CC(C)CCCn1ccc2cccc(CN)c21.
What is the InChIKey of [1-(4-methylpentyl)indol-7-yl]methanamine?
The InChIKey is HCVGRGVYDQDTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-12(2)5-4-9-17-10-8-13-6-3-7-14(11-16)15(13)17/h3,6-8,10,12H,4-5,9,11,16H2,1-2H3.
What are the key properties of [1-(4-methylpentyl)indol-7-yl]methanamine?
[1-(4-methylpentyl)indol-7-yl]methanamine has a molecular weight of 230.35 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methylpentyl)indol-7-yl]methanamine is sourced from PubChem (CID 83169213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).