2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol

C19H25NO — CID 60901862

IUPAC2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol
SMILESCCc1cccc(NCC(O)c2ccc(C(C)C)cc2)c1
InChIInChI=1S/C19H25NO/c1-4-15-6-5-7-18(12-15)20-13-19(21)17-10-8-16(9-11-17)14(2)3/h5-12,14,19-21H,4,13H2,1-3H3
InChIKeyCZIZTTZZVPEIAD-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.52
Rot. Bonds6

About 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol

2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol (PubChem CID 60901862) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol
PubChem CID60901862
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol
SMILESCCc1cccc(NCC(O)c2ccc(C(C)C)cc2)c1
InChIInChI=1S/C19H25NO/c1-4-15-6-5-7-18(12-15)20-13-19(21)17-10-8-16(9-11-17)14(2)3/h5-12,14,19-21H,4,13H2,1-3H3
InChIKeyCZIZTTZZVPEIAD-UHFFFAOYSA-N
XLogP4.52
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.52
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
4-[1-hydroxy-2-(3-propan-2-ylanilino)ethyl]benzonitrile
CID 60900218
1-(dimethylamino)-3-(3-ethylanilino)propan-2-ol
CID 60902054
1-(3-ethylphenyl)-3-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]urea
CID 51944765
1-(3-ethylanilino)ethanol
CID 174601913
methyl 3-(3-ethylanilino)-2-methylpropanoate
CID 43538563
2-(3-bromo-4-methylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 63492470
2-(2,6-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 62330797
2-(4-bromoanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 63487797
2-(3-bromoanilino)-1-(4-chlorophenyl)ethanol
CID 60724934
(E)-N-(3-ethylphenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 6161453

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol (CID 60901862) is 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol is CCc1cccc(NCC(O)c2ccc(C(C)C)cc2)c1.
What is the InChIKey of 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
The InChIKey is CZIZTTZZVPEIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-4-15-6-5-7-18(12-15)20-13-19(21)17-10-8-16(9-11-17)14(2)3/h5-12,14,19-21H,4,13H2,1-3H3.
What are the key properties of 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol?
2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol has a molecular weight of 283.42 g/mol, XLogP of 4.52, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylanilino)-1-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 60901862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).