[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine

C15H22N2 — CID 115106249

IUPAC[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine
SMILESNCC1Cc2ccccc2N1CC1CCCC1
InChIInChI=1S/C15H22N2/c16-10-14-9-13-7-3-4-8-15(13)17(14)11-12-5-1-2-6-12/h3-4,7-8,12,14H,1-2,5-6,9-11,16H2
InChIKeyXLKXREUEAUBMJY-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.57
Rot. Bonds3

About [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine

[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine (PubChem CID 115106249) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine.

Molecular Properties

Compound Name[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine
PubChem CID115106249
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine
SMILESNCC1Cc2ccccc2N1CC1CCCC1
InChIInChI=1S/C15H22N2/c16-10-14-9-13-7-3-4-8-15(13)17(14)11-12-5-1-2-6-12/h3-4,7-8,12,14H,1-2,5-6,9-11,16H2
InChIKeyXLKXREUEAUBMJY-UHFFFAOYSA-N
XLogP2.57
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(cyclobutylmethyl)-2,3-dihydroindol-2-yl]ethanol
CID 115106208
3-[1-(cyclobutylmethyl)-2,3-dihydroindol-2-yl]-2-methylpropanoic acid
CID 115106341
1-[1-(cyclobutylmethyl)-2,3-dihydroindol-2-yl]ethanone
CID 115106312
N-methyl-1-[1-(oxan-4-ylmethyl)-2,3-dihydroindol-2-yl]propan-2-amine
CID 115106288
1-(cyclopropylmethyl)-2,3-dihydroindole-2-carbaldehyde
CID 115106309
3-[1-(oxan-4-ylmethyl)-2,3-dihydroindol-2-yl]propanoic acid
CID 115106344
[1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-quinolin-2-yl]methanamine
CID 107912592
2-(1-benzyl-2,3-dihydroindol-2-yl)ethanamine
CID 115107304
1-(cyclopentylmethyl)-3,4-dihydro-2H-quinoline
CID 82078705
(2S)-1-(piperidin-4-ylmethyl)-2,3-dihydroindole-2-carboxamide;hydrochloride
CID 119930985
3-tert-butyl-1-(cyclopentylmethyl)-2,3,4,5-tetrahydro-1,4-benzodiazepine
CID 79906826
2-[4-(cyclohexylmethyl)piperazin-1-yl]aniline
CID 28800779

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine?
The IUPAC name of [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine (CID 115106249) is [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine.
What is the SMILES notation for [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine?
The canonical SMILES for [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine is NCC1Cc2ccccc2N1CC1CCCC1.
What is the InChIKey of [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine?
The InChIKey is XLKXREUEAUBMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c16-10-14-9-13-7-3-4-8-15(13)17(14)11-12-5-1-2-6-12/h3-4,7-8,12,14H,1-2,5-6,9-11,16H2.
What are the key properties of [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine?
[1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine has a molecular weight of 230.35 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopentylmethyl)-2,3-dihydroindol-2-yl]methanamine is sourced from PubChem (CID 115106249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).