2-anilino-2-(2,5-dimethylphenyl)ethanol

C16H19NO — CID 54977554

IUPAC2-anilino-2-(2,5-dimethylphenyl)ethanol
SMILESCc1ccc(C)c(C(CO)Nc2ccccc2)c1
InChIInChI=1S/C16H19NO/c1-12-8-9-13(2)15(10-12)16(11-18)17-14-6-4-3-5-7-14/h3-10,16-18H,11H2,1-2H3
InChIKeyOYJDEBFXNHWQJR-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.45
Rot. Bonds4

About 2-anilino-2-(2,5-dimethylphenyl)ethanol

2-anilino-2-(2,5-dimethylphenyl)ethanol (PubChem CID 54977554) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-anilino-2-(2,5-dimethylphenyl)ethanol.

Molecular Properties

Compound Name2-anilino-2-(2,5-dimethylphenyl)ethanol
PubChem CID54977554
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-anilino-2-(2,5-dimethylphenyl)ethanol
SMILESCc1ccc(C)c(C(CO)Nc2ccccc2)c1
InChIInChI=1S/C16H19NO/c1-12-8-9-13(2)15(10-12)16(11-18)17-14-6-4-3-5-7-14/h3-10,16-18H,11H2,1-2H3
InChIKeyOYJDEBFXNHWQJR-UHFFFAOYSA-N
XLogP3.45
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2,5-dimethylphenyl)-2-(methylamino)ethanol
CID 55276234
2-(2-fluorophenyl)-2-(3-methylanilino)ethanol
CID 61050184
2-(3-bromoanilino)-2-(2-methylphenyl)ethanol
CID 61048065
2-(2-ethylphenyl)-2-(3-methylanilino)ethanol
CID 55067115
2-(cyclopentylamino)-2-(2,5-dimethylphenyl)ethanol
CID 54977603
3-(2,5-dimethylphenyl)-3-(methylamino)propan-1-ol
CID 64812187
2-(3-methylanilino)-2-(3-methylphenyl)ethanol
CID 61050180
1-(2,5-dimethylphenyl)-N-(4-methoxyphenyl)ethane-1,2-diamine
CID 65384942
2-anilino-2-(2,4-dimethoxyphenyl)ethanol
CID 61047149
2-anilino-2-(5-bromo-2-chlorophenyl)ethanol
CID 114077180
2-[[(2,5-dimethylphenyl)-phenylmethyl]amino]ethanol
CID 43151186
1-(2,5-dimethylphenyl)-N-methylpropan-1-amine
CID 43483756

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-(2,5-dimethylphenyl)ethanol?
The IUPAC name of 2-anilino-2-(2,5-dimethylphenyl)ethanol (CID 54977554) is 2-anilino-2-(2,5-dimethylphenyl)ethanol.
What is the SMILES notation for 2-anilino-2-(2,5-dimethylphenyl)ethanol?
The canonical SMILES for 2-anilino-2-(2,5-dimethylphenyl)ethanol is Cc1ccc(C)c(C(CO)Nc2ccccc2)c1.
What is the InChIKey of 2-anilino-2-(2,5-dimethylphenyl)ethanol?
The InChIKey is OYJDEBFXNHWQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-12-8-9-13(2)15(10-12)16(11-18)17-14-6-4-3-5-7-14/h3-10,16-18H,11H2,1-2H3.
What are the key properties of 2-anilino-2-(2,5-dimethylphenyl)ethanol?
2-anilino-2-(2,5-dimethylphenyl)ethanol has a molecular weight of 241.33 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-(2,5-dimethylphenyl)ethanol is sourced from PubChem (CID 54977554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).