2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine

C15H22N2 — CID 115106109

IUPAC2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine
SMILESCNCCc1cccc2c1CCN2CC1CC1
InChIInChI=1S/C15H22N2/c1-16-9-7-13-3-2-4-15-14(13)8-10-17(15)11-12-5-6-12/h2-4,12,16H,5-11H2,1H3
InChIKeyUOPMQVLHDCVTGX-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.22
Rot. Bonds5

About 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine

2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine (PubChem CID 115106109) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine.

Molecular Properties

Compound Name2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine
PubChem CID115106109
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine
SMILESCNCCc1cccc2c1CCN2CC1CC1
InChIInChI=1S/C15H22N2/c1-16-9-7-13-3-2-4-15-14(13)8-10-17(15)11-12-5-6-12/h2-4,12,16H,5-11H2,1H3
InChIKeyUOPMQVLHDCVTGX-UHFFFAOYSA-N
XLogP2.22
TPSA15.27 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 ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine?
The IUPAC name of 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine (CID 115106109) is 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine.
What is the SMILES notation for 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine?
The canonical SMILES for 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine is CNCCc1cccc2c1CCN2CC1CC1.
What is the InChIKey of 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine?
The InChIKey is UOPMQVLHDCVTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-16-9-7-13-3-2-4-15-14(13)8-10-17(15)11-12-5-6-12/h2-4,12,16H,5-11H2,1H3.
What are the key properties of 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine?
2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine has a molecular weight of 230.35 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclopropylmethyl)-2,3-dihydroindol-4-yl]-N-methylethanamine is sourced from PubChem (CID 115106109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).