1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol

C19H24O — CID 105079612

IUPAC1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol
SMILESCc1cc(C)cc(CC(O)CCc2ccccc2C)c1
InChIInChI=1S/C19H24O/c1-14-10-15(2)12-17(11-14)13-19(20)9-8-18-7-5-4-6-16(18)3/h4-7,10-12,19-20H,8-9,13H2,1-3H3
InChIKeyAWDUGWUOTNQRCO-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.15
Rot. Bonds5

About 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol

1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol (PubChem CID 105079612) has the molecular formula C19H24O and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol.

Molecular Properties

Compound Name1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol
PubChem CID105079612
Molecular FormulaC19H24O
Molecular Weight268.40 g/mol
Exact Mass268.18
IUPAC Name1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol
SMILESCc1cc(C)cc(CC(O)CCc2ccccc2C)c1
InChIInChI=1S/C19H24O/c1-14-10-15(2)12-17(11-14)13-19(20)9-8-18-7-5-4-6-16(18)3/h4-7,10-12,19-20H,8-9,13H2,1-3H3
InChIKeyAWDUGWUOTNQRCO-UHFFFAOYSA-N
XLogP4.15
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 ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2-methylphenyl)-1-(2,4,6-trimethylphenyl)butan-2-ol
CID 105084187
1-(4-ethylphenyl)-4-(2-methylphenyl)butan-2-ol
CID 105080198
1-(3-chlorophenyl)-4-(2-methylphenyl)butan-2-ol
CID 63016247
1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-ol
CID 55149163
4-(3-methylphenyl)-1-phenylbutan-2-ol
CID 63016612
1,3-bis(3,5-dimethylphenyl)propan-2-ol
CID 63411020
1-(2-methylphenyl)-3-(4-methylphenyl)propan-2-ol
CID 55137869
1-(2-methylphenyl)decan-3-ol
CID 105085012
1-(3,4-dimethylphenyl)-4-(3-methylphenyl)butan-2-ol
CID 63520342
4-(dimethylamino)-1-(2-methylphenyl)butan-2-ol
CID 115345853
4-(2-methylphenyl)-1-propoxybutan-2-ol
CID 105111883
1,4-bis(4-methylphenyl)butan-2-ol
CID 63016226

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol?
The IUPAC name of 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol (CID 105079612) is 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol.
What is the SMILES notation for 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol?
The canonical SMILES for 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol is Cc1cc(C)cc(CC(O)CCc2ccccc2C)c1.
What is the InChIKey of 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol?
The InChIKey is AWDUGWUOTNQRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O/c1-14-10-15(2)12-17(11-14)13-19(20)9-8-18-7-5-4-6-16(18)3/h4-7,10-12,19-20H,8-9,13H2,1-3H3.
What are the key properties of 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol?
1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol has a molecular weight of 268.40 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylphenyl)-4-(2-methylphenyl)butan-2-ol is sourced from PubChem (CID 105079612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).