3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride

C15H14Cl2N2 — CID 12500217

IUPAC3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride
SMILESCl.Cn1c(N)c(-c2ccc(Cl)cc2)c2ccccc21
InChIInChI=1S/C15H13ClN2.ClH/c1-18-13-5-3-2-4-12(13)14(15(18)17)10-6-8-11(16)9-7-10;/h2-9H,17H2,1H3;1H
InChIKeyDVKBLSXIKZHQAL-UHFFFAOYSA-N
MW293.20 g/mol
LogP4.50
Rot. Bonds1

About 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride

3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride (PubChem CID 12500217) has the molecular formula C15H14Cl2N2 and a molecular weight of 293.20 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride.

Molecular Properties

Compound Name3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride
PubChem CID12500217
Molecular FormulaC15H14Cl2N2
Molecular Weight293.20 g/mol
Exact Mass292.05
IUPAC Name3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride
SMILESCl.Cn1c(N)c(-c2ccc(Cl)cc2)c2ccccc21
InChIInChI=1S/C15H13ClN2.ClH/c1-18-13-5-3-2-4-12(13)14(15(18)17)10-6-8-11(16)9-7-10;/h2-9H,17H2,1H3;1H
InChIKeyDVKBLSXIKZHQAL-UHFFFAOYSA-N
XLogP4.50
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.20
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride?
The IUPAC name of 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride (CID 12500217) is 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride.
What is the SMILES notation for 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride?
The canonical SMILES for 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride is Cl.Cn1c(N)c(-c2ccc(Cl)cc2)c2ccccc21.
What is the InChIKey of 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride?
The InChIKey is DVKBLSXIKZHQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2.ClH/c1-18-13-5-3-2-4-12(13)14(15(18)17)10-6-8-11(16)9-7-10;/h2-9H,17H2,1H3;1H.
What are the key properties of 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride?
3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride has a molecular weight of 293.20 g/mol, XLogP of 4.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-1-methylindol-2-amine;hydrochloride is sourced from PubChem (CID 12500217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).