2-indol-1-yl-N-methylaniline

C15H14N2 — CID 162411052

IUPAC2-indol-1-yl-N-methylaniline
SMILESCNc1ccccc1-n1ccc2ccccc21
InChIInChI=1S/C15H14N2/c1-16-13-7-3-5-9-15(13)17-11-10-12-6-2-4-8-14(12)17/h2-11,16H,1H3
InChIKeyQLNJKCJGLAVCDS-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.67
Rot. Bonds2

About 2-indol-1-yl-N-methylaniline

2-indol-1-yl-N-methylaniline (PubChem CID 162411052) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-indol-1-yl-N-methylaniline.

Molecular Properties

Compound Name2-indol-1-yl-N-methylaniline
PubChem CID162411052
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name2-indol-1-yl-N-methylaniline
SMILESCNc1ccccc1-n1ccc2ccccc21
InChIInChI=1S/C15H14N2/c1-16-13-7-3-5-9-15(13)17-11-10-12-6-2-4-8-14(12)17/h2-11,16H,1H3
InChIKeyQLNJKCJGLAVCDS-UHFFFAOYSA-N
XLogP3.67
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-indol-1-ylbenzaldehyde
CID 22400862
1-(2,3,4,5-tetrafluorophenyl)indole
CID 22638233
4-indol-1-yl-N,5-dimethyl-1,3,5-triazin-5-ium-2-amine
CID 23371648
4-indol-1-yl-N,6-dimethylpyridin-2-amine
CID 19029060
1-(2-indol-1-ylphenyl)-2-methylpropan-2-ol
CID 70602665
1-(3-methyl-4-pyridinyl)indole
CID 59685306
4-indol-1-ylisoquinoline
CID 68997324
ethane;1-methylindole;N-methylmethanamine
CID 54113940
1-(furan-2-yl)indole
CID 70543237
1-(2-chloro-4-fluorophenyl)indole
CID 139914970
4,7-di(indol-1-yl)-1,10-phenanthroline
CID 102455108
N,1-dimethylindol-2-amine
CID 11744928

Frequently Asked Questions

What is the IUPAC name of 2-indol-1-yl-N-methylaniline?
The IUPAC name of 2-indol-1-yl-N-methylaniline (CID 162411052) is 2-indol-1-yl-N-methylaniline.
What is the SMILES notation for 2-indol-1-yl-N-methylaniline?
The canonical SMILES for 2-indol-1-yl-N-methylaniline is CNc1ccccc1-n1ccc2ccccc21.
What is the InChIKey of 2-indol-1-yl-N-methylaniline?
The InChIKey is QLNJKCJGLAVCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-16-13-7-3-5-9-15(13)17-11-10-12-6-2-4-8-14(12)17/h2-11,16H,1H3.
What are the key properties of 2-indol-1-yl-N-methylaniline?
2-indol-1-yl-N-methylaniline has a molecular weight of 222.29 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indol-1-yl-N-methylaniline is sourced from PubChem (CID 162411052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).