7-chloro-1-[(2,6-difluorophenyl)methyl]indole

C15H10ClF2N — CID 103475121

IUPAC7-chloro-1-[(2,6-difluorophenyl)methyl]indole
SMILESFc1cccc(F)c1Cn1ccc2cccc(Cl)c21
InChIInChI=1S/C15H10ClF2N/c16-12-4-1-3-10-7-8-19(15(10)12)9-11-13(17)5-2-6-14(11)18/h1-8H,9H2
InChIKeyGZPKOCCIHMZZMP-UHFFFAOYSA-N
MW277.70 g/mol
LogP4.62
Rot. Bonds2

About 7-chloro-1-[(2,6-difluorophenyl)methyl]indole

7-chloro-1-[(2,6-difluorophenyl)methyl]indole (PubChem CID 103475121) has the molecular formula C15H10ClF2N and a molecular weight of 277.70 g/mol. Its IUPAC name is 7-chloro-1-[(2,6-difluorophenyl)methyl]indole.

Molecular Properties

Compound Name7-chloro-1-[(2,6-difluorophenyl)methyl]indole
PubChem CID103475121
Molecular FormulaC15H10ClF2N
Molecular Weight277.70 g/mol
Exact Mass277.05
IUPAC Name7-chloro-1-[(2,6-difluorophenyl)methyl]indole
SMILESFc1cccc(F)c1Cn1ccc2cccc(Cl)c21
InChIInChI=1S/C15H10ClF2N/c16-12-4-1-3-10-7-8-19(15(10)12)9-11-13(17)5-2-6-14(11)18/h1-8H,9H2
InChIKeyGZPKOCCIHMZZMP-UHFFFAOYSA-N
XLogP4.62
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.70
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-chloro-1-[(2,6-dimethylphenyl)methyl]indole
CID 103475380
7-chloro-1-[(2,4,6-trimethylphenyl)methyl]indole
CID 103475068
7-chloro-1-[(2-chloro-5-fluorophenyl)methyl]indole
CID 103475124
1-[(5-bromo-2-fluorophenyl)methyl]-7-chloroindole
CID 103475026
1-[(2,6-difluorophenyl)methyl]indole
CID 22256904
1-[(2,6-dichlorophenyl)methyl]indol-7-amine
CID 114935944
1-[(2-bromo-4-fluorophenyl)methyl]-7-chloroindole
CID 103474913
potassium (7-chloroindol-1-yl)methyl-trifluoroboranuide
CID 103474693
7-chloro-1-(2-methoxyethyl)indole
CID 103474736
[1-[(3-chloro-2-fluorophenyl)methyl]indol-7-yl]methanamine
CID 102861922
1-[(3-chloro-2-fluorophenyl)methyl]-7-ethylindole
CID 102861491
5-[(7-chloroindol-1-yl)methyl]-1,3-thiazole
CID 103475549

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-[(2,6-difluorophenyl)methyl]indole?
The IUPAC name of 7-chloro-1-[(2,6-difluorophenyl)methyl]indole (CID 103475121) is 7-chloro-1-[(2,6-difluorophenyl)methyl]indole.
What is the SMILES notation for 7-chloro-1-[(2,6-difluorophenyl)methyl]indole?
The canonical SMILES for 7-chloro-1-[(2,6-difluorophenyl)methyl]indole is Fc1cccc(F)c1Cn1ccc2cccc(Cl)c21.
What is the InChIKey of 7-chloro-1-[(2,6-difluorophenyl)methyl]indole?
The InChIKey is GZPKOCCIHMZZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF2N/c16-12-4-1-3-10-7-8-19(15(10)12)9-11-13(17)5-2-6-14(11)18/h1-8H,9H2.
What are the key properties of 7-chloro-1-[(2,6-difluorophenyl)methyl]indole?
7-chloro-1-[(2,6-difluorophenyl)methyl]indole has a molecular weight of 277.70 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-[(2,6-difluorophenyl)methyl]indole is sourced from PubChem (CID 103475121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).