1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine

C16H24N2 — CID 80566715

IUPAC1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine
SMILESCC1(CNCC2CNc3ccccc32)CCCC1
InChIInChI=1S/C16H24N2/c1-16(8-4-5-9-16)12-17-10-13-11-18-15-7-3-2-6-14(13)15/h2-3,6-7,13,17-18H,4-5,8-12H2,1H3
InChIKeyGTSOMDKXZPCLJV-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.37
Rot. Bonds4

About 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine

1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine (PubChem CID 80566715) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine
PubChem CID80566715
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine
SMILESCC1(CNCC2CNc3ccccc32)CCCC1
InChIInChI=1S/C16H24N2/c1-16(8-4-5-9-16)12-17-10-13-11-18-15-7-3-2-6-14(13)15/h2-3,6-7,13,17-18H,4-5,8-12H2,1H3
InChIKeyGTSOMDKXZPCLJV-UHFFFAOYSA-N
XLogP3.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine?
The IUPAC name of 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine (CID 80566715) is 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine is CC1(CNCC2CNc3ccccc32)CCCC1.
What is the InChIKey of 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine?
The InChIKey is GTSOMDKXZPCLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-16(8-4-5-9-16)12-17-10-13-11-18-15-7-3-2-6-14(13)15/h2-3,6-7,13,17-18H,4-5,8-12H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine?
1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine has a molecular weight of 244.38 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-indol-3-yl)-N-[(1-methylcyclopentyl)methyl]methanamine is sourced from PubChem (CID 80566715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).