(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol

C15H11ClFNO — CID 115351816

IUPAC(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol
SMILESOC(c1c(F)cccc1Cl)c1cccc2[nH]ccc12
InChIInChI=1S/C15H11ClFNO/c16-11-4-2-5-12(17)14(11)15(19)10-3-1-6-13-9(10)7-8-18-13/h1-8,15,18-19H
InChIKeyYANLKVOMDLNLQU-UHFFFAOYSA-N
MW275.71 g/mol
LogP4.04
Rot. Bonds2

About (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol

(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol (PubChem CID 115351816) has the molecular formula C15H11ClFNO and a molecular weight of 275.71 g/mol. Its IUPAC name is (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol.

Molecular Properties

Compound Name(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol
PubChem CID115351816
Molecular FormulaC15H11ClFNO
Molecular Weight275.71 g/mol
Exact Mass275.05
IUPAC Name(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol
SMILESOC(c1c(F)cccc1Cl)c1cccc2[nH]ccc12
InChIInChI=1S/C15H11ClFNO/c16-11-4-2-5-12(17)14(11)15(19)10-3-1-6-13-9(10)7-8-18-13/h1-8,15,18-19H
InChIKeyYANLKVOMDLNLQU-UHFFFAOYSA-N
XLogP4.04
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.71
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(2,6-dichlorophenyl)-(1H-indol-4-yl)methanol
CID 115351810
(2-fluorophenyl)-(1H-indol-4-yl)methanol
CID 113292217
(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol
CID 115351822
(4-chloro-2-fluorophenyl)-(1H-indol-4-yl)methanol
CID 114852920
(2-chloro-6-fluorophenyl)-(2,4-dichlorophenyl)methanol
CID 61271392
1H-indol-4-yl-[2-(trifluoromethyl)phenyl]methanol
CID 115351825
(2-chloro-6-fluorophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 63895624
(5-bromo-2-fluorophenyl)-(2-chloro-6-fluorophenyl)methanol
CID 79743340
(3,5-dimethylphenyl)-(1H-indol-4-yl)methanol
CID 115351861
2-amino-1-(1H-indol-4-yl)ethanol
CID 13186941
3-amino-1-(1H-indol-4-yl)propan-1-ol
CID 54551349
2-ethyl-1-(1H-indol-4-yl)butan-1-ol
CID 115351832

Frequently Asked Questions

What is the IUPAC name of (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol?
The IUPAC name of (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol (CID 115351816) is (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol.
What is the SMILES notation for (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol?
The canonical SMILES for (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol is OC(c1c(F)cccc1Cl)c1cccc2[nH]ccc12.
What is the InChIKey of (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol?
The InChIKey is YANLKVOMDLNLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFNO/c16-11-4-2-5-12(17)14(11)15(19)10-3-1-6-13-9(10)7-8-18-13/h1-8,15,18-19H.
What are the key properties of (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol?
(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol has a molecular weight of 275.71 g/mol, XLogP of 4.04, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol is sourced from PubChem (CID 115351816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).