6-chloro-2-methyl-1-phenylindole

C15H12ClN — CID 171405843

IUPAC6-chloro-2-methyl-1-phenylindole
SMILESCc1cc2ccc(Cl)cc2n1-c1ccccc1
InChIInChI=1S/C15H12ClN/c1-11-9-12-7-8-13(16)10-15(12)17(11)14-5-3-2-4-6-14/h2-10H,1H3
InChIKeyRXCMHXCNYVNMPJ-UHFFFAOYSA-N
MW241.72 g/mol
LogP4.59
Rot. Bonds1

About 6-chloro-2-methyl-1-phenylindole

6-chloro-2-methyl-1-phenylindole (PubChem CID 171405843) has the molecular formula C15H12ClN and a molecular weight of 241.72 g/mol. Its IUPAC name is 6-chloro-2-methyl-1-phenylindole.

Molecular Properties

Compound Name6-chloro-2-methyl-1-phenylindole
PubChem CID171405843
Molecular FormulaC15H12ClN
Molecular Weight241.72 g/mol
Exact Mass241.07
IUPAC Name6-chloro-2-methyl-1-phenylindole
SMILESCc1cc2ccc(Cl)cc2n1-c1ccccc1
InChIInChI=1S/C15H12ClN/c1-11-9-12-7-8-13(16)10-15(12)17(11)14-5-3-2-4-6-14/h2-10H,1H3
InChIKeyRXCMHXCNYVNMPJ-UHFFFAOYSA-N
XLogP4.59
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-benzyl-6-chloro-2-methylindole
CID 121404424
5-chloro-1,3-diphenylbenzimidazol-2-one
CID 3061785
1-(4-bromophenyl)-2-methylindole
CID 22951419
5-chloro-2,3-dimethyl-1-phenylbenzimidazol-3-ium
CID 785008
2-chloro-9-phenyl-6-(9-phenylcarbazol-2-yl)carbazole
CID 152827310
7-chloro-10-phenyl-14,21-dioxa-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaene
CID 145390303
6-chloro-1-phenyl-2-(trifluoromethyl)benzimidazole
CID 83450606
3-(6-chloro-2-methylindol-1-yl)propan-1-amine
CID 82494548
5-chloro-3-phenyl-1H-benzimidazole-2-thione
CID 3061814
ethyl 2-[[1-(4-chlorophenyl)-2-methylindol-6-yl]methyl]butanoate
CID 156677927
5-chloro-2-(1-chloroethyl)-1-phenylbenzimidazole
CID 43667015
6-chloro-N,1-diphenylbenzimidazol-2-amine
CID 46854683

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-1-phenylindole?
The IUPAC name of 6-chloro-2-methyl-1-phenylindole (CID 171405843) is 6-chloro-2-methyl-1-phenylindole.
What is the SMILES notation for 6-chloro-2-methyl-1-phenylindole?
The canonical SMILES for 6-chloro-2-methyl-1-phenylindole is Cc1cc2ccc(Cl)cc2n1-c1ccccc1.
What is the InChIKey of 6-chloro-2-methyl-1-phenylindole?
The InChIKey is RXCMHXCNYVNMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN/c1-11-9-12-7-8-13(16)10-15(12)17(11)14-5-3-2-4-6-14/h2-10H,1H3.
What are the key properties of 6-chloro-2-methyl-1-phenylindole?
6-chloro-2-methyl-1-phenylindole has a molecular weight of 241.72 g/mol, XLogP of 4.59, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methyl-1-phenylindole is sourced from PubChem (CID 171405843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).