2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol

C18H23NO — CID 82123675

IUPAC2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol
SMILESCc1cc(C)c(C(O)CNc2ccccc2C)c(C)c1
InChIInChI=1S/C18H23NO/c1-12-9-14(3)18(15(4)10-12)17(20)11-19-16-8-6-5-7-13(16)2/h5-10,17,19-20H,11H2,1-4H3
InChIKeyHOYUDIMPPNDUMZ-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.07
Rot. Bonds4

About 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol

2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol (PubChem CID 82123675) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol
PubChem CID82123675
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol
SMILESCc1cc(C)c(C(O)CNc2ccccc2C)c(C)c1
InChIInChI=1S/C18H23NO/c1-12-9-14(3)18(15(4)10-12)17(20)11-19-16-8-6-5-7-13(16)2/h5-10,17,19-20H,11H2,1-4H3
InChIKeyHOYUDIMPPNDUMZ-UHFFFAOYSA-N
XLogP4.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(hydroxyamino)-1-(2,4,6-trimethylphenyl)ethanol
CID 82112148
1-(4-fluoro-3-methylphenyl)-2-(2-methylanilino)ethanol
CID 82121205
1-(2-methoxy-5-methylphenyl)-2-(2-methylanilino)ethanol
CID 60900549
2-(2-methylanilino)-1-pyridin-3-ylethanol
CID 82040364
N-(2-ethylbutyl)-2-methylaniline
CID 29290197
2-(propylamino)-1-(2,4,6-trimethylphenyl)ethanol
CID 62774498
4-(2-methylanilino)butan-2-ol
CID 112693026
1-N-(2-methylphenyl)butane-1,2-diamine
CID 19374458
2-(2,4-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60903681
2-(2,5-dimethylanilino)-1-pyridin-2-ylethanol
CID 82044534
2-[(4-fluorophenyl)methylamino]-1-(2,4,6-trimethylphenyl)ethanol
CID 82314891
2-(5-chloro-2-methylanilino)-1-phenylethanol
CID 60721635

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol?
The IUPAC name of 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol (CID 82123675) is 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol.
What is the SMILES notation for 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol?
The canonical SMILES for 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol is Cc1cc(C)c(C(O)CNc2ccccc2C)c(C)c1.
What is the InChIKey of 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol?
The InChIKey is HOYUDIMPPNDUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-12-9-14(3)18(15(4)10-12)17(20)11-19-16-8-6-5-7-13(16)2/h5-10,17,19-20H,11H2,1-4H3.
What are the key properties of 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol?
2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol has a molecular weight of 269.39 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylanilino)-1-(2,4,6-trimethylphenyl)ethanol is sourced from PubChem (CID 82123675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).