2-[(2-chlorophenyl)methyl]-1H-indole

C15H12ClN — CID 70108058

IUPAC2-[(2-chlorophenyl)methyl]-1H-indole
SMILESClc1ccccc1Cc1cc2ccccc2[nH]1
InChIInChI=1S/C15H12ClN/c16-14-7-3-1-5-11(14)9-13-10-12-6-2-4-8-15(12)17-13/h1-8,10,17H,9H2
InChIKeyAYBWSTOSMGALTE-UHFFFAOYSA-N
MW241.72 g/mol
LogP4.41
Rot. Bonds2

About 2-[(2-chlorophenyl)methyl]-1H-indole

2-[(2-chlorophenyl)methyl]-1H-indole (PubChem CID 70108058) has the molecular formula C15H12ClN and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methyl]-1H-indole.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methyl]-1H-indole
PubChem CID70108058
Molecular FormulaC15H12ClN
Molecular Weight241.72 g/mol
Exact Mass241.07
IUPAC Name2-[(2-chlorophenyl)methyl]-1H-indole
SMILESClc1ccccc1Cc1cc2ccccc2[nH]1
InChIInChI=1S/C15H12ClN/c16-14-7-3-1-5-11(14)9-13-10-12-6-2-4-8-15(12)17-13/h1-8,10,17H,9H2
InChIKeyAYBWSTOSMGALTE-UHFFFAOYSA-N
XLogP4.41
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

6-chloro-3-(1H-indol-2-ylmethyl)-1H-indole
CID 134502336
1-[2-(2-chlorophenyl)ethyl]-3-(1H-indol-2-ylmethyl)-2-methylguanidine;hydroiodide
CID 111882826
4-bromo-3-(1H-indol-2-ylmethyl)-1H-indole
CID 134502321
2-(3-chloropropyl)-1H-indole
CID 13271043
2-(2-fluoroethyl)-1H-indole
CID 142633825
2-(1H-indol-2-yl)ethanamine;hydroiodide
CID 175201769
4-[(2-chlorophenyl)methyl]-2-methyl-1H-benzimidazole
CID 140992503
N'-hydroxy-2-(1H-indol-2-yl)ethanimidamide
CID 119086971
2-(4-methylpentyl)-1H-indole
CID 18761636
boric acid;2-(iodomethyl)-1H-indole
CID 174056153
methyl 2-[4-(1H-indol-2-ylmethyl)phenyl]acetate
CID 70109234
2-(1H-indol-2-ylmethyl)-4,5-dihydro-1,3-oxazole
CID 173051883

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methyl]-1H-indole?
The IUPAC name of 2-[(2-chlorophenyl)methyl]-1H-indole (CID 70108058) is 2-[(2-chlorophenyl)methyl]-1H-indole.
What is the SMILES notation for 2-[(2-chlorophenyl)methyl]-1H-indole?
The canonical SMILES for 2-[(2-chlorophenyl)methyl]-1H-indole is Clc1ccccc1Cc1cc2ccccc2[nH]1.
What is the InChIKey of 2-[(2-chlorophenyl)methyl]-1H-indole?
The InChIKey is AYBWSTOSMGALTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN/c16-14-7-3-1-5-11(14)9-13-10-12-6-2-4-8-15(12)17-13/h1-8,10,17H,9H2.
What are the key properties of 2-[(2-chlorophenyl)methyl]-1H-indole?
2-[(2-chlorophenyl)methyl]-1H-indole has a molecular weight of 241.72 g/mol, XLogP of 4.41, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methyl]-1H-indole is sourced from PubChem (CID 70108058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).