2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol

C15H15Cl2NO2 — CID 61048677

IUPAC2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol
SMILESCOc1cccc(NC(CO)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C15H15Cl2NO2/c1-20-12-4-2-3-11(8-12)18-15(9-19)10-5-6-13(16)14(17)7-10/h2-8,15,18-19H,9H2,1H3
InChIKeyJGHMDZWJZXGTPZ-UHFFFAOYSA-N
MW312.20 g/mol
LogP4.15
Rot. Bonds5

About 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol

2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol (PubChem CID 61048677) has the molecular formula C15H15Cl2NO2 and a molecular weight of 312.20 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol
PubChem CID61048677
Molecular FormulaC15H15Cl2NO2
Molecular Weight312.20 g/mol
Exact Mass311.05
IUPAC Name2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol
SMILESCOc1cccc(NC(CO)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C15H15Cl2NO2/c1-20-12-4-2-3-11(8-12)18-15(9-19)10-5-6-13(16)14(17)7-10/h2-8,15,18-19H,9H2,1H3
InChIKeyJGHMDZWJZXGTPZ-UHFFFAOYSA-N
XLogP4.15
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.20
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)acetamide
CID 60995627
2-fluoro-4-[2-hydroxy-1-(3-methoxyanilino)ethyl]phenol
CID 107693461
2-(3-chloroanilino)-2-(3-chloro-4-methoxyphenyl)ethanol
CID 65026318
2-(3-chloro-4-methylphenyl)-2-(3-methylanilino)ethanol
CID 106818139
2-(3-chloroanilino)-2-(3-chloro-4-methylphenyl)ethanol
CID 106818136
2-(3-methoxyanilino)-2-(1,3-thiazol-5-yl)ethanol
CID 113373098
3-methoxy-N-[1-(4-methoxyphenyl)propyl]aniline
CID 43196395
(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
CID 61083356
2-(3-chloro-4-methoxyphenyl)-2-(4-fluoroanilino)ethanol
CID 65026319
2-(3,4-dichlorophenyl)-2-(2-methoxyethylamino)ethanol
CID 62543484
3,4-dichloro-N-[1-(3-methoxyphenyl)ethyl]aniline
CID 43108106
2-(3-chloroanilino)-2-(3-chlorophenyl)ethanol
CID 61049948

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol?
The IUPAC name of 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol (CID 61048677) is 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol?
The canonical SMILES for 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol is COc1cccc(NC(CO)c2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol?
The InChIKey is JGHMDZWJZXGTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO2/c1-20-12-4-2-3-11(8-12)18-15(9-19)10-5-6-13(16)14(17)7-10/h2-8,15,18-19H,9H2,1H3.
What are the key properties of 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol?
2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol has a molecular weight of 312.20 g/mol, XLogP of 4.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)ethanol is sourced from PubChem (CID 61048677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).