[6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol

C15H11Cl2NO2 — CID 135358431

IUPAC[6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol
SMILESOCc1cc2c(Oc3ccccc3Cl)cc(Cl)cc2[nH]1
InChIInChI=1S/C15H11Cl2NO2/c16-9-5-13-11(7-10(8-19)18-13)15(6-9)20-14-4-2-1-3-12(14)17/h1-7,18-19H,8H2
InChIKeySGJPJBPRFLTWGF-UHFFFAOYSA-N
MW308.16 g/mol
LogP4.76
Rot. Bonds3

About [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol

[6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol (PubChem CID 135358431) has the molecular formula C15H11Cl2NO2 and a molecular weight of 308.16 g/mol. Its IUPAC name is [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol.

Molecular Properties

Compound Name[6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol
PubChem CID135358431
Molecular FormulaC15H11Cl2NO2
Molecular Weight308.16 g/mol
Exact Mass307.02
IUPAC Name[6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol
SMILESOCc1cc2c(Oc3ccccc3Cl)cc(Cl)cc2[nH]1
InChIInChI=1S/C15H11Cl2NO2/c16-9-5-13-11(7-10(8-19)18-13)15(6-9)20-14-4-2-1-3-12(14)17/h1-7,18-19H,8H2
InChIKeySGJPJBPRFLTWGF-UHFFFAOYSA-N
XLogP4.76
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.16
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(2-chlorophenoxy)quinolin-2-yl]methanol
CID 63375932
[4-(2-chlorophenoxy)-3,5-difluorophenyl]methanol
CID 63077057
(4-bromo-6-phenoxy-1H-indol-2-yl)methanol
CID 135358038
methyl 4-(2-chlorophenoxy)-1H-indole-2-carboxylate
CID 135358278
N-[4-chloro-2-(2-chlorophenoxy)phenyl]hydroxylamine
CID 87857015
2-[(2-chlorophenoxy)methyl]-1H-indole-4-carboxylic acid
CID 117173534
2-chloro-6-(2-chlorophenoxy)phenol
CID 101247244
4,6-dichloro-2-ethyl-1H-indole
CID 20828571
(4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)methanol
CID 118140301
[2-(2-chlorophenoxy)-4-pyridinyl]methanol
CID 61256084
[2-bromo-4-(2-chlorophenoxy)phenyl]methanol
CID 114060389
1-chloro-2-(chloromethyl)-3-(2-chlorophenoxy)benzene
CID 28947164

Frequently Asked Questions

What is the IUPAC name of [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol?
The IUPAC name of [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol (CID 135358431) is [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol.
What is the SMILES notation for [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol?
The canonical SMILES for [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol is OCc1cc2c(Oc3ccccc3Cl)cc(Cl)cc2[nH]1.
What is the InChIKey of [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol?
The InChIKey is SGJPJBPRFLTWGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO2/c16-9-5-13-11(7-10(8-19)18-13)15(6-9)20-14-4-2-1-3-12(14)17/h1-7,18-19H,8H2.
What are the key properties of [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol?
[6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol has a molecular weight of 308.16 g/mol, XLogP of 4.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-chloro-4-(2-chlorophenoxy)-1H-indol-2-yl]methanol is sourced from PubChem (CID 135358431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).