3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol

C15H24O2 — CID 63895461

IUPAC3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol
SMILESCCC(CC)C(O)Cc1cc(C)ccc1OC
InChIInChI=1S/C15H24O2/c1-5-12(6-2)14(16)10-13-9-11(3)7-8-15(13)17-4/h7-9,12,14,16H,5-6,10H2,1-4H3
InChIKeyWUYQOKGDCWZDLH-UHFFFAOYSA-N
MW236.35 g/mol
LogP3.34
Rot. Bonds6

About 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol

3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol (PubChem CID 63895461) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol.

Molecular Properties

Compound Name3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol
PubChem CID63895461
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol
SMILESCCC(CC)C(O)Cc1cc(C)ccc1OC
InChIInChI=1S/C15H24O2/c1-5-12(6-2)14(16)10-13-9-11(3)7-8-15(13)17-4/h7-9,12,14,16H,5-6,10H2,1-4H3
InChIKeyWUYQOKGDCWZDLH-UHFFFAOYSA-N
XLogP3.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methoxy-5-methylphenyl)hexane-2,3-diol
CID 103454840
1-(2,5-dimethylphenyl)-3-ethylpentan-2-ol
CID 63016045
2-(3-bromo-2-ethylbutyl)-1-methoxy-4-methylbenzene
CID 63470462
1-(2-methoxy-5-methylphenyl)butan-2-amine;hydrochloride
CID 170889680
1,2-bis(2-methoxy-5-methylphenyl)ethanol
CID 115781516
butane;1-methoxy-4-methyl-2-(2-methylbutyl)benzene
CID 144898289
1-(2-methoxy-5-methylphenyl)-4-methylpentan-2-ol
CID 62161527
4-methoxy-1-(2-methoxy-5-methylphenyl)butan-2-ol
CID 62161184
1-(2-methoxy-5-methylphenyl)decan-2-ol
CID 115781450
1-methoxy-4-methyl-2-(3-methyl-2-propan-2-ylbutyl)benzene
CID 171593330
3-hydroxy-4-(2-methoxy-5-methylphenyl)butanoic acid
CID 82080605
3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-one
CID 114965728

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol?
The IUPAC name of 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol (CID 63895461) is 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol.
What is the SMILES notation for 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol?
The canonical SMILES for 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol is CCC(CC)C(O)Cc1cc(C)ccc1OC.
What is the InChIKey of 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol?
The InChIKey is WUYQOKGDCWZDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2/c1-5-12(6-2)14(16)10-13-9-11(3)7-8-15(13)17-4/h7-9,12,14,16H,5-6,10H2,1-4H3.
What are the key properties of 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol?
3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol has a molecular weight of 236.35 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-methoxy-5-methylphenyl)pentan-2-ol is sourced from PubChem (CID 63895461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).