[2-(2,6-dichloro-3-methylanilino)phenyl]methanol

C14H13Cl2NO — CID 15027375

IUPAC[2-(2,6-dichloro-3-methylanilino)phenyl]methanol
SMILESCc1ccc(Cl)c(Nc2ccccc2CO)c1Cl
InChIInChI=1S/C14H13Cl2NO/c1-9-6-7-11(15)14(13(9)16)17-12-5-3-2-4-10(12)8-18/h2-7,17-18H,8H2,1H3
InChIKeyCYMGTBRYIDZNJQ-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.54
Rot. Bonds3

About [2-(2,6-dichloro-3-methylanilino)phenyl]methanol

[2-(2,6-dichloro-3-methylanilino)phenyl]methanol (PubChem CID 15027375) has the molecular formula C14H13Cl2NO and a molecular weight of 282.17 g/mol. Its IUPAC name is [2-(2,6-dichloro-3-methylanilino)phenyl]methanol.

Molecular Properties

Compound Name[2-(2,6-dichloro-3-methylanilino)phenyl]methanol
PubChem CID15027375
Molecular FormulaC14H13Cl2NO
Molecular Weight282.17 g/mol
Exact Mass281.04
IUPAC Name[2-(2,6-dichloro-3-methylanilino)phenyl]methanol
SMILESCc1ccc(Cl)c(Nc2ccccc2CO)c1Cl
InChIInChI=1S/C14H13Cl2NO/c1-9-6-7-11(15)14(13(9)16)17-12-5-3-2-4-10(12)8-18/h2-7,17-18H,8H2,1H3
InChIKeyCYMGTBRYIDZNJQ-UHFFFAOYSA-N
XLogP4.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dichloro-3-methylanilino)benzenethiol
CID 137454964
2-(2,6-dichloro-3-methylanilino)-N-(hydroxymethyl)benzamide
CID 57034426
6-(2,6-dichloro-3-methylanilino)(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carboxylic acid
CID 164516784
N-[1-[2-(2,6-dichloro-3-methylanilino)phenyl]ethylidene]hydroxylamine
CID 86744462
sodium;2-(2,6-dichloro-3-methylanilino)benzoate;hydrate
CID 23663959
sodium;2-(2,6-dichloro-3-methylanilino)benzoate;dihydrate
CID 23702523
2-[2-(2,6-dichloro-3-methylanilino)benzoyl]oxyacetic acid
CID 19842359
bis(2-(2,6-dichloro-3-methylanilino)benzoic acid);4-pyridin-4-ylpyridine
CID 139145966
azane;ethoxymethyl 2-(2,6-dichloro-3-methylanilino)benzoate
CID 70150385
[2-(2,6-dichloro-3-methylanilino)phenyl]-ethoxyphosphinate
CID 149046188
2-bromo-6-(2,6-dichloro-3-methylanilino)benzenecarbothioamide
CID 114881787
butane;ethoxymethyl 2-(2,6-dichloro-3-methylanilino)benzoate
CID 70500245

Frequently Asked Questions

What is the IUPAC name of [2-(2,6-dichloro-3-methylanilino)phenyl]methanol?
The IUPAC name of [2-(2,6-dichloro-3-methylanilino)phenyl]methanol (CID 15027375) is [2-(2,6-dichloro-3-methylanilino)phenyl]methanol.
What is the SMILES notation for [2-(2,6-dichloro-3-methylanilino)phenyl]methanol?
The canonical SMILES for [2-(2,6-dichloro-3-methylanilino)phenyl]methanol is Cc1ccc(Cl)c(Nc2ccccc2CO)c1Cl.
What is the InChIKey of [2-(2,6-dichloro-3-methylanilino)phenyl]methanol?
The InChIKey is CYMGTBRYIDZNJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO/c1-9-6-7-11(15)14(13(9)16)17-12-5-3-2-4-10(12)8-18/h2-7,17-18H,8H2,1H3.
What are the key properties of [2-(2,6-dichloro-3-methylanilino)phenyl]methanol?
[2-(2,6-dichloro-3-methylanilino)phenyl]methanol has a molecular weight of 282.17 g/mol, XLogP of 4.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dichloro-3-methylanilino)phenyl]methanol is sourced from PubChem (CID 15027375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).