1-methoxy-3-methyl-2-phenylpentan-2-ol

C13H20O2 — CID 103465659

IUPAC1-methoxy-3-methyl-2-phenylpentan-2-ol
SMILESCCC(C)C(O)(COC)c1ccccc1
InChIInChI=1S/C13H20O2/c1-4-11(2)13(14,10-15-3)12-8-6-5-7-9-12/h5-9,11,14H,4,10H2,1-3H3
InChIKeyIEIORLAMZRXRNC-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.57
Rot. Bonds5

About 1-methoxy-3-methyl-2-phenylpentan-2-ol

1-methoxy-3-methyl-2-phenylpentan-2-ol (PubChem CID 103465659) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-methoxy-3-methyl-2-phenylpentan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-methyl-2-phenylpentan-2-ol
PubChem CID103465659
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name1-methoxy-3-methyl-2-phenylpentan-2-ol
SMILESCCC(C)C(O)(COC)c1ccccc1
InChIInChI=1S/C13H20O2/c1-4-11(2)13(14,10-15-3)12-8-6-5-7-9-12/h5-9,11,14H,4,10H2,1-3H3
InChIKeyIEIORLAMZRXRNC-UHFFFAOYSA-N
XLogP2.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-4-methoxy-2-methyl-3-phenylbutanoic acid
CID 103465941
ethyl 3-hydroxy-4-methoxy-3-phenyl-2-propan-2-ylbutanoate
CID 103465940
3-methyl-2-phenylpentan-2-ol
CID 13024634
2-methoxy-1-(2-methoxyphenyl)-1-phenylethanol
CID 103465436
1-(2,2,2-triphenylethoxy)ethane-1,1-diol
CID 54503444
methyl 2-ethyl-3-hydroxy-5-methyl-3-phenylhexanoate
CID 62394570
2-methoxy-1-(4-methylphenyl)-1-phenylethanol
CID 50903538
1-methoxy-2-phenylpentan-2-ol
CID 79566426
1-(2,6-dimethoxyphenyl)-2-methoxy-1-phenylethanol
CID 103465566
methyl 2-ethyl-3-hydroxy-3-phenylpentanoate
CID 62394588
1-(2-ethoxyphenyl)-2-methoxy-1-phenylethanol
CID 103465363
3-methoxy-1,1-diphenylbutan-1-ol
CID 13380056

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-methyl-2-phenylpentan-2-ol?
The IUPAC name of 1-methoxy-3-methyl-2-phenylpentan-2-ol (CID 103465659) is 1-methoxy-3-methyl-2-phenylpentan-2-ol.
What is the SMILES notation for 1-methoxy-3-methyl-2-phenylpentan-2-ol?
The canonical SMILES for 1-methoxy-3-methyl-2-phenylpentan-2-ol is CCC(C)C(O)(COC)c1ccccc1.
What is the InChIKey of 1-methoxy-3-methyl-2-phenylpentan-2-ol?
The InChIKey is IEIORLAMZRXRNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-4-11(2)13(14,10-15-3)12-8-6-5-7-9-12/h5-9,11,14H,4,10H2,1-3H3.
What are the key properties of 1-methoxy-3-methyl-2-phenylpentan-2-ol?
1-methoxy-3-methyl-2-phenylpentan-2-ol has a molecular weight of 208.30 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-methyl-2-phenylpentan-2-ol is sourced from PubChem (CID 103465659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).