1-(4-methoxyphenyl)pentan-2-ol

C12H18O2 — CID 61375325

IUPAC1-(4-methoxyphenyl)pentan-2-ol
SMILESCCCC(O)Cc1ccc(OC)cc1
InChIInChI=1S/C12H18O2/c1-3-4-11(13)9-10-5-7-12(14-2)8-6-10/h5-8,11,13H,3-4,9H2,1-2H3
InChIKeyOEUXAZRVDHRZSV-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.40
Rot. Bonds5

About 1-(4-methoxyphenyl)pentan-2-ol

1-(4-methoxyphenyl)pentan-2-ol (PubChem CID 61375325) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)pentan-2-ol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)pentan-2-ol
PubChem CID61375325
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name1-(4-methoxyphenyl)pentan-2-ol
SMILESCCCC(O)Cc1ccc(OC)cc1
InChIInChI=1S/C12H18O2/c1-3-4-11(13)9-10-5-7-12(14-2)8-6-10/h5-8,11,13H,3-4,9H2,1-2H3
InChIKeyOEUXAZRVDHRZSV-UHFFFAOYSA-N
XLogP2.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxyphenyl)hexan-2-ol
CID 62608607
1-(4-methoxyphenyl)nonan-2-ol
CID 62608606
4-ethoxy-1-(4-methoxyphenyl)butan-2-ol
CID 62606919
9-hydroxy-10-(4-methoxyphenyl)decan-5-one
CID 101095744
1-(3-methoxyphenyl)pentan-2-ol
CID 61261615
(2S)-1-methoxy-3-(4-methoxyphenyl)propan-2-ol
CID 101107331
1-(4-iodophenyl)-4-(4-methoxyphenyl)butan-2-ol
CID 115802735
1-(4-bromophenyl)-4-(4-methoxyphenyl)butan-2-ol
CID 63015995
1-(4-chlorophenyl)-3-(4-methoxyphenyl)propan-2-ol
CID 61375521
1-amino-3-(4-methoxyphenyl)propan-2-ol;hydrochloride
CID 67019748
1-(4-methoxyphenyl)-3-propylhexan-2-amine
CID 82987770
1-(3,5-dimethylphenyl)-3-(4-methoxyphenyl)propan-2-ol
CID 61375136

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)pentan-2-ol?
The IUPAC name of 1-(4-methoxyphenyl)pentan-2-ol (CID 61375325) is 1-(4-methoxyphenyl)pentan-2-ol.
What is the SMILES notation for 1-(4-methoxyphenyl)pentan-2-ol?
The canonical SMILES for 1-(4-methoxyphenyl)pentan-2-ol is CCCC(O)Cc1ccc(OC)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)pentan-2-ol?
The InChIKey is OEUXAZRVDHRZSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-3-4-11(13)9-10-5-7-12(14-2)8-6-10/h5-8,11,13H,3-4,9H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)pentan-2-ol?
1-(4-methoxyphenyl)pentan-2-ol has a molecular weight of 194.27 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)pentan-2-ol is sourced from PubChem (CID 61375325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).