2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol

C19H25NO — CID 62330797

IUPAC2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol
SMILESCc1cccc(C)c1NCC(O)c1ccc(C(C)C)cc1
InChIInChI=1S/C19H25NO/c1-13(2)16-8-10-17(11-9-16)18(21)12-20-19-14(3)6-5-7-15(19)4/h5-11,13,18,20-21H,12H2,1-4H3
InChIKeyAUBAKGWGYPVEBD-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.57
Rot. Bonds5

About 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol

2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol (PubChem CID 62330797) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol
PubChem CID62330797
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol
SMILESCc1cccc(C)c1NCC(O)c1ccc(C(C)C)cc1
InChIInChI=1S/C19H25NO/c1-13(2)16-8-10-17(11-9-16)18(21)12-20-19-14(3)6-5-7-15(19)4/h5-11,13,18,20-21H,12H2,1-4H3
InChIKeyAUBAKGWGYPVEBD-UHFFFAOYSA-N
XLogP4.57
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60902513
2-(3-chloroanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60897560
2-(2,4-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60903681
2-(2,6-dimethylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 109007530
2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60901862
2-(3-bromo-4-methylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 63492470
2-(4-bromoanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 63487797
2-(2-chloro-4-iodoanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 107606651
2-(2-fluoro-4-methylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60901348
1-[[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]amino]-4-methylpentan-2-ol
CID 107152724
1-phenyl-2-[1-(4-propan-2-ylphenyl)ethylamino]ethanol
CID 43388825
2,6-dimethyl-N-(2-methylpentyl)aniline;molecular hydrogen
CID 155692558

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol (CID 62330797) is 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol is Cc1cccc(C)c1NCC(O)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
The InChIKey is AUBAKGWGYPVEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13(2)16-8-10-17(11-9-16)18(21)12-20-19-14(3)6-5-7-15(19)4/h5-11,13,18,20-21H,12H2,1-4H3.
What are the key properties of 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol has a molecular weight of 283.42 g/mol, XLogP of 4.57, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 62330797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).