[1-(1-methylindol-7-yl)piperidin-2-yl]methanamine

C15H21N3 — CID 82386099

IUPAC[1-(1-methylindol-7-yl)piperidin-2-yl]methanamine
SMILESCn1ccc2cccc(N3CCCCC3CN)c21
InChIInChI=1S/C15H21N3/c1-17-10-8-12-5-4-7-14(15(12)17)18-9-3-2-6-13(18)11-16/h4-5,7-8,10,13H,2-3,6,9,11,16H2,1H3
InChIKeyFONRVPUIHKWFFK-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.50
Rot. Bonds2

About [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine

[1-(1-methylindol-7-yl)piperidin-2-yl]methanamine (PubChem CID 82386099) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(1-methylindol-7-yl)piperidin-2-yl]methanamine
PubChem CID82386099
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name[1-(1-methylindol-7-yl)piperidin-2-yl]methanamine
SMILESCn1ccc2cccc(N3CCCCC3CN)c21
InChIInChI=1S/C15H21N3/c1-17-10-8-12-5-4-7-14(15(12)17)18-9-3-2-6-13(18)11-16/h4-5,7-8,10,13H,2-3,6,9,11,16H2,1H3
InChIKeyFONRVPUIHKWFFK-UHFFFAOYSA-N
XLogP2.50
TPSA34.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine?
The IUPAC name of [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine (CID 82386099) is [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine.
What is the SMILES notation for [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine?
The canonical SMILES for [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine is Cn1ccc2cccc(N3CCCCC3CN)c21.
What is the InChIKey of [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine?
The InChIKey is FONRVPUIHKWFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-17-10-8-12-5-4-7-14(15(12)17)18-9-3-2-6-13(18)11-16/h4-5,7-8,10,13H,2-3,6,9,11,16H2,1H3.
What are the key properties of [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine?
[1-(1-methylindol-7-yl)piperidin-2-yl]methanamine has a molecular weight of 243.35 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylindol-7-yl)piperidin-2-yl]methanamine is sourced from PubChem (CID 82386099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).