2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol

C17H20ClNO2 — CID 66252932

IUPAC2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1C(O)CNc1c(C)cccc1Cl
InChIInChI=1S/C17H20ClNO2/c1-11-7-8-16(21-3)13(9-11)15(20)10-19-17-12(2)5-4-6-14(17)18/h4-9,15,19-20H,10H2,1-3H3
InChIKeyGYCYSIZVFULBHF-UHFFFAOYSA-N
MW305.81 g/mol
LogP4.11
Rot. Bonds5

About 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol

2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol (PubChem CID 66252932) has the molecular formula C17H20ClNO2 and a molecular weight of 305.81 g/mol. Its IUPAC name is 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol
PubChem CID66252932
Molecular FormulaC17H20ClNO2
Molecular Weight305.81 g/mol
Exact Mass305.12
IUPAC Name2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol
SMILESCOc1ccc(C)cc1C(O)CNc1c(C)cccc1Cl
InChIInChI=1S/C17H20ClNO2/c1-11-7-8-16(21-3)13(9-11)15(20)10-19-17-12(2)5-4-6-14(17)18/h4-9,15,19-20H,10H2,1-3H3
InChIKeyGYCYSIZVFULBHF-UHFFFAOYSA-N
XLogP4.11
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.81
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-chloroanilino)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60897559
1-(2-methoxy-5-methylphenyl)-2-(2-methylanilino)ethanol
CID 60900549
2-(4-bromo-2-chloroanilino)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60901198
2-(3-ethynylanilino)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60902936
2-(tert-butylamino)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60901325
2-(4-chloro-2-fluoroanilino)-1-(2-methoxy-5-methylphenyl)ethanol
CID 61469773
(2-chloro-6-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 104817103
1-[[2-hydroxy-2-(2-methoxy-5-methylphenyl)ethyl]amino]-2-methylpropan-2-ol
CID 65106127
2-(benzylamino)-1-(2-methoxy-5-methylphenyl)ethanol
CID 60896859
2-(4-bromo-2,6-dimethylanilino)-1-(2-chlorophenyl)ethanol
CID 63490045
1-(2-methoxy-5-methylphenyl)-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethanol
CID 81408941
2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 61081695

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol?
The IUPAC name of 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol (CID 66252932) is 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol.
What is the SMILES notation for 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol?
The canonical SMILES for 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol is COc1ccc(C)cc1C(O)CNc1c(C)cccc1Cl.
What is the InChIKey of 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol?
The InChIKey is GYCYSIZVFULBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClNO2/c1-11-7-8-16(21-3)13(9-11)15(20)10-19-17-12(2)5-4-6-14(17)18/h4-9,15,19-20H,10H2,1-3H3.
What are the key properties of 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol?
2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol has a molecular weight of 305.81 g/mol, XLogP of 4.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-methylanilino)-1-(2-methoxy-5-methylphenyl)ethanol is sourced from PubChem (CID 66252932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).