1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol

C14H20O2 — CID 103564336

IUPAC1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol
SMILESCOc1ccc(CCC2(O)CC(C)C2)cc1
InChIInChI=1S/C14H20O2/c1-11-9-14(15,10-11)8-7-12-3-5-13(16-2)6-4-12/h3-6,11,15H,7-10H2,1-2H3
InChIKeyRMZNMMSJIBGYHB-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.79
Rot. Bonds4

About 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol

1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol (PubChem CID 103564336) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol
PubChem CID103564336
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol
SMILESCOc1ccc(CCC2(O)CC(C)C2)cc1
InChIInChI=1S/C14H20O2/c1-11-9-14(15,10-11)8-7-12-3-5-13(16-2)6-4-12/h3-6,11,15H,7-10H2,1-2H3
InChIKeyRMZNMMSJIBGYHB-UHFFFAOYSA-N
XLogP2.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(4-methoxyphenyl)ethyl]-3,3-dimethylcyclopentan-1-ol
CID 80698548
1-[2-(4-methoxyphenyl)ethyl]-2,4-dimethylcyclohexan-1-ol
CID 65444720
1-[2-[(1R,2S)-2-chloro-1-methylcyclopropyl]ethyl]-4-methoxybenzene
CID 101110349
1-[2-[(1R,2R)-2-chloro-1-methylcyclopropyl]ethyl]-4-methoxybenzene
CID 101110346
1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclopentane-1-carboxylic acid
CID 79428861
3-[2-(4-methoxyphenyl)ethyl]-2-methylthian-3-ol
CID 79951268
6-[(4-methoxyphenyl)methyl]bicyclo[3.1.0]hexan-6-ol
CID 79331242
1-(aminomethyl)-N-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutane-1-carboxamide
CID 80587190
1-[2-(4-methoxyphenyl)ethyl]-2-methylcyclohexan-1-amine
CID 65444722
1-[2-(4-methoxyphenyl)ethyl]-3-azabicyclo[3.1.1]heptane-2,4-dione
CID 167652584
S-[2-(4-methoxyphenyl)ethyl] 2,2,6-trimethylcyclohexane-1-carbothioate
CID 138572000
1-(1-adamantyl)-3-(4-methoxyphenyl)propan-1-one
CID 135008863

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol?
The IUPAC name of 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol (CID 103564336) is 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol?
The canonical SMILES for 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol is COc1ccc(CCC2(O)CC(C)C2)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol?
The InChIKey is RMZNMMSJIBGYHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-11-9-14(15,10-11)8-7-12-3-5-13(16-2)6-4-12/h3-6,11,15H,7-10H2,1-2H3.
What are the key properties of 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol?
1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol has a molecular weight of 220.31 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)ethyl]-3-methylcyclobutan-1-ol is sourced from PubChem (CID 103564336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).