3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol

C14H22O3 — CID 62801618

IUPAC3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol
SMILESCCC(O)(c1ccc(OC)cc1OC)C(C)C
InChIInChI=1S/C14H22O3/c1-6-14(15,10(2)3)12-8-7-11(16-4)9-13(12)17-5/h7-10,15H,6H2,1-5H3
InChIKeyDAAMKYGOUIIHQB-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.96
Rot. Bonds5

About 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol

3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol (PubChem CID 62801618) has the molecular formula C14H22O3 and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol.

Molecular Properties

Compound Name3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol
PubChem CID62801618
Molecular FormulaC14H22O3
Molecular Weight238.33 g/mol
Exact Mass238.16
IUPAC Name3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol
SMILESCCC(O)(c1ccc(OC)cc1OC)C(C)C
InChIInChI=1S/C14H22O3/c1-6-14(15,10(2)3)12-8-7-11(16-4)9-13(12)17-5/h7-10,15H,6H2,1-5H3
InChIKeyDAAMKYGOUIIHQB-UHFFFAOYSA-N
XLogP2.96
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol
CID 65313856
3-(2,4-dimethoxyphenyl)pentan-3-ol
CID 62801128
(2R)-2-(2,4-dimethoxyphenyl)pentan-2-ol
CID 97048528
1-(1,1-difluoropropyl)-2,4-dimethoxybenzene
CID 116841246
2-(2,4-dimethoxyphenyl)propane-1,2-diol
CID 82713060
1-(2,4-dimethoxyphenyl)-1-[4-(hydroxymethyl)-3-methoxyphenyl]-2-methylpropan-1-ol
CID 58480144
3-amino-2-(2,4-dimethoxyphenyl)-1,1,1-trifluoropentan-2-ol
CID 63082925
2-(2,4-dimethoxyphenyl)-1-(ethylamino)propan-2-ol
CID 62774366
3-(3-methoxyphenyl)-2-methylpentan-3-ol;N-methylmethanamine
CID 68829384
bis(2,4-dimethoxyphenyl)-phenylmethanol
CID 10833633
methyl 3-(2,4-dimethoxyphenyl)-3-hydroxy-2-methylbutanoate
CID 62393818
1-(1-chloro-2-methylpropan-2-yl)-2,4-dimethoxybenzene
CID 82081448

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol?
The IUPAC name of 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol (CID 62801618) is 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol.
What is the SMILES notation for 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol?
The canonical SMILES for 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol is CCC(O)(c1ccc(OC)cc1OC)C(C)C.
What is the InChIKey of 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol?
The InChIKey is DAAMKYGOUIIHQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O3/c1-6-14(15,10(2)3)12-8-7-11(16-4)9-13(12)17-5/h7-10,15H,6H2,1-5H3.
What are the key properties of 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol?
3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol has a molecular weight of 238.33 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol is sourced from PubChem (CID 62801618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).