2-(4-chlorophenyl)-2-(2-methylanilino)ethanol

C15H16ClNO — CID 61045329

IUPAC2-(4-chlorophenyl)-2-(2-methylanilino)ethanol
SMILESCc1ccccc1NC(CO)c1ccc(Cl)cc1
InChIInChI=1S/C15H16ClNO/c1-11-4-2-3-5-14(11)17-15(10-18)12-6-8-13(16)9-7-12/h2-9,15,17-18H,10H2,1H3
InChIKeyAVJMZEVMJROIRA-UHFFFAOYSA-N
MW261.75 g/mol
LogP3.79
Rot. Bonds4

About 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol

2-(4-chlorophenyl)-2-(2-methylanilino)ethanol (PubChem CID 61045329) has the molecular formula C15H16ClNO and a molecular weight of 261.75 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-(2-methylanilino)ethanol
PubChem CID61045329
Molecular FormulaC15H16ClNO
Molecular Weight261.75 g/mol
Exact Mass261.09
IUPAC Name2-(4-chlorophenyl)-2-(2-methylanilino)ethanol
SMILESCc1ccccc1NC(CO)c1ccc(Cl)cc1
InChIInChI=1S/C15H16ClNO/c1-11-4-2-3-5-14(11)17-15(10-18)12-6-8-13(16)9-7-12/h2-9,15,17-18H,10H2,1H3
InChIKeyAVJMZEVMJROIRA-UHFFFAOYSA-N
XLogP3.79
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloroanilino)-2-(4-chlorophenyl)ethanol
CID 61048136
2-(3-chloro-4-methylphenyl)-2-(2-methylanilino)ethanol
CID 106818134
2-(4-chlorophenyl)-2-(2-fluoroanilino)ethanol
CID 61050485
2-(3-bromophenyl)-2-(2-methylanilino)ethanol
CID 61045334
2-[3-(difluoromethyl)phenyl]-2-(2-methylanilino)ethanol
CID 115528113
2-(3-fluorophenyl)-2-(2-methylanilino)ethanol
CID 61047365
5-[2-hydroxy-1-(2-methylanilino)ethyl]-2-methoxyphenol
CID 61047518
(2R)-2-(4-chlorophenyl)-2-(2-methylanilino)acetate
CID 7148181
2-(2-aminoanilino)-2-(4-methylphenyl)ethanol
CID 139535831
2-(5-chloro-1,3-thiazol-2-yl)-2-(2-methylanilino)ethanol
CID 107125175
2-(2-methylanilino)-2-naphthalen-1-ylethanol
CID 61047528
2-(2-methoxyphenyl)-2-(2-methylanilino)ethanol
CID 61047526

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol?
The IUPAC name of 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol (CID 61045329) is 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol.
What is the SMILES notation for 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol?
The canonical SMILES for 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol is Cc1ccccc1NC(CO)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol?
The InChIKey is AVJMZEVMJROIRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO/c1-11-4-2-3-5-14(11)17-15(10-18)12-6-8-13(16)9-7-12/h2-9,15,17-18H,10H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol?
2-(4-chlorophenyl)-2-(2-methylanilino)ethanol has a molecular weight of 261.75 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-(2-methylanilino)ethanol is sourced from PubChem (CID 61045329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).