1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine

C17H20N2 — CID 13324747

IUPAC1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1cccc(N2CCc3ccccc32)c1
InChIInChI=1S/C17H20N2/c1-18(2)13-14-6-5-8-16(12-14)19-11-10-15-7-3-4-9-17(15)19/h3-9,12H,10-11,13H2,1-2H3
InChIKeyRHMZBONCLOWECP-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.44
Rot. Bonds3

About 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine

1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine (PubChem CID 13324747) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine
PubChem CID13324747
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1cccc(N2CCc3ccccc32)c1
InChIInChI=1S/C17H20N2/c1-18(2)13-14-6-5-8-16(12-14)19-11-10-15-7-3-4-9-17(15)19/h3-9,12H,10-11,13H2,1-2H3
InChIKeyRHMZBONCLOWECP-UHFFFAOYSA-N
XLogP3.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine (CID 13324747) is 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine is CN(C)Cc1cccc(N2CCc3ccccc32)c1.
What is the InChIKey of 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine?
The InChIKey is RHMZBONCLOWECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-18(2)13-14-6-5-8-16(12-14)19-11-10-15-7-3-4-9-17(15)19/h3-9,12H,10-11,13H2,1-2H3.
What are the key properties of 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine?
1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine has a molecular weight of 252.36 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2,3-dihydroindol-1-yl)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 13324747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).