1-(4-methoxy-2-methylphenyl)propan-1-ol

C11H16O2 — CID 13147116

IUPAC1-(4-methoxy-2-methylphenyl)propan-1-ol
SMILESCCC(O)c1ccc(OC)cc1C
InChIInChI=1S/C11H16O2/c1-4-11(12)10-6-5-9(13-3)7-8(10)2/h5-7,11-12H,4H2,1-3H3
InChIKeyGEQFDNVMYBRGEC-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.45
Rot. Bonds3

About 1-(4-methoxy-2-methylphenyl)propan-1-ol

1-(4-methoxy-2-methylphenyl)propan-1-ol (PubChem CID 13147116) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name1-(4-methoxy-2-methylphenyl)propan-1-ol
PubChem CID13147116
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name1-(4-methoxy-2-methylphenyl)propan-1-ol
SMILESCCC(O)c1ccc(OC)cc1C
InChIInChI=1S/C11H16O2/c1-4-11(12)10-6-5-9(13-3)7-8(10)2/h5-7,11-12H,4H2,1-3H3
InChIKeyGEQFDNVMYBRGEC-UHFFFAOYSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxy-2-methylphenyl)octan-1-ol
CID 61101302
3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 65313094
3-ethoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 105083019
1-(4-methoxy-2-methylphenyl)-2-propoxyethanol
CID 65313194
3,3,3-trifluoro-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 61101293
(1R,2S)-1-amino-1-(4-methoxy-2-methylphenyl)butan-2-ol
CID 171265166
3-ethylsulfanyl-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 116504533
1-(1-bromopropyl)-4-methoxy-2-methylbenzene
CID 61097886
(1S)-1-(4-methoxy-2-methylphenyl)propan-1-amine;hydrochloride
CID 171233415
(1R)-1-(4-methoxy-2-methylphenyl)propan-1-amine;hydrochloride
CID 168719792
2,2-dichloro-1-(4-methoxy-2-methylphenyl)ethanol
CID 164892247
2,3-dihydroxy-3-(4-methoxy-2-methylphenyl)propanoic acid
CID 170823897

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylphenyl)propan-1-ol?
The IUPAC name of 1-(4-methoxy-2-methylphenyl)propan-1-ol (CID 13147116) is 1-(4-methoxy-2-methylphenyl)propan-1-ol.
What is the SMILES notation for 1-(4-methoxy-2-methylphenyl)propan-1-ol?
The canonical SMILES for 1-(4-methoxy-2-methylphenyl)propan-1-ol is CCC(O)c1ccc(OC)cc1C.
What is the InChIKey of 1-(4-methoxy-2-methylphenyl)propan-1-ol?
The InChIKey is GEQFDNVMYBRGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2/c1-4-11(12)10-6-5-9(13-3)7-8(10)2/h5-7,11-12H,4H2,1-3H3.
What are the key properties of 1-(4-methoxy-2-methylphenyl)propan-1-ol?
1-(4-methoxy-2-methylphenyl)propan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylphenyl)propan-1-ol is sourced from PubChem (CID 13147116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).