5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole

C15H17ClN2 — CID 15619875

IUPAC5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
SMILESCc1[nH]c2ccc(Cl)cc2c1C1=CCN(C)CC1
InChIInChI=1S/C15H17ClN2/c1-10-15(11-5-7-18(2)8-6-11)13-9-12(16)3-4-14(13)17-10/h3-5,9,17H,6-8H2,1-2H3
InChIKeyLMCOFCDHKVXZOD-UHFFFAOYSA-N
MW260.77 g/mol
LogP3.85
Rot. Bonds1

About 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole

5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole (PubChem CID 15619875) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole.

Molecular Properties

Compound Name5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
PubChem CID15619875
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
SMILESCc1[nH]c2ccc(Cl)cc2c1C1=CCN(C)CC1
InChIInChI=1S/C15H17ClN2/c1-10-15(11-5-7-18(2)8-6-11)13-9-12(16)3-4-14(13)17-10/h3-5,9,17H,6-8H2,1-2H3
InChIKeyLMCOFCDHKVXZOD-UHFFFAOYSA-N
XLogP3.85
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole 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 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole?
The IUPAC name of 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole (CID 15619875) is 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole.
What is the SMILES notation for 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole?
The canonical SMILES for 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole is Cc1[nH]c2ccc(Cl)cc2c1C1=CCN(C)CC1.
What is the InChIKey of 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole?
The InChIKey is LMCOFCDHKVXZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-10-15(11-5-7-18(2)8-6-11)13-9-12(16)3-4-14(13)17-10/h3-5,9,17H,6-8H2,1-2H3.
What are the key properties of 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole?
5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole has a molecular weight of 260.77 g/mol, XLogP of 3.85, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methyl-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole is sourced from PubChem (CID 15619875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).