1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol

C19H24O — CID 63085891

IUPAC1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol
SMILESCCc1ccc(CC(O)C(C)(C)c2ccccc2)cc1
InChIInChI=1S/C19H24O/c1-4-15-10-12-16(13-11-15)14-18(20)19(2,3)17-8-6-5-7-9-17/h5-13,18,20H,4,14H2,1-3H3
InChIKeyBJDQPOUFPLTYGQ-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.13
Rot. Bonds5

About 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol

1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol (PubChem CID 63085891) has the molecular formula C19H24O and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol.

Molecular Properties

Compound Name1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol
PubChem CID63085891
Molecular FormulaC19H24O
Molecular Weight268.40 g/mol
Exact Mass268.18
IUPAC Name1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol
SMILESCCc1ccc(CC(O)C(C)(C)c2ccccc2)cc1
InChIInChI=1S/C19H24O/c1-4-15-10-12-16(13-11-15)14-18(20)19(2,3)17-8-6-5-7-9-17/h5-13,18,20H,4,14H2,1-3H3
InChIKeyBJDQPOUFPLTYGQ-UHFFFAOYSA-N
XLogP4.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-bromophenyl)-3-methyl-3-phenylbutan-2-ol
CID 63083837
1-(1-ethylpyrazol-4-yl)-3-methyl-3-phenylbutan-2-ol
CID 63084667
(2S)-3,3-dimethyl-1-phenylbutan-2-ol
CID 12689722
3,3-dimethyl-1-phenylbutan-2-ol
CID 5051506
1-(4-fluoro-2-methylphenyl)-3-methyl-3-phenylbutan-2-ol
CID 114347441
3-(4-fluorophenyl)-3-methyl-1-(4-methylphenyl)butan-2-ol
CID 64769125
1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol
CID 83172363
1-(4-chlorophenyl)-3-(4-fluorophenyl)-3-methylbutan-2-ol
CID 64770114
1-(4-bromophenyl)-3-(4-fluorophenyl)-3-methylbutan-2-ol
CID 64769134
3,3-diethyl-1-phenylpentan-2-ol
CID 141275578
(4-ethylphenyl)-phenylmethanediamine
CID 139628675
3-methyl-1,3-diphenylbutan-2-amine
CID 63086399

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol?
The IUPAC name of 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol (CID 63085891) is 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol.
What is the SMILES notation for 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol?
The canonical SMILES for 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol is CCc1ccc(CC(O)C(C)(C)c2ccccc2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol?
The InChIKey is BJDQPOUFPLTYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O/c1-4-15-10-12-16(13-11-15)14-18(20)19(2,3)17-8-6-5-7-9-17/h5-13,18,20H,4,14H2,1-3H3.
What are the key properties of 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol?
1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol has a molecular weight of 268.40 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol is sourced from PubChem (CID 63085891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).