7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol

C14H18O2 — CID 79331888

IUPAC7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol
SMILESCOc1ccc(C2(O)C3CCCCC32)cc1
InChIInChI=1S/C14H18O2/c1-16-11-8-6-10(7-9-11)14(15)12-4-2-3-5-13(12)14/h6-9,12-13,15H,2-5H2,1H3
InChIKeyPYCQFRYGZMYOHG-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.70
Rot. Bonds2

About 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol

7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol (PubChem CID 79331888) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol.

Molecular Properties

Compound Name7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol
PubChem CID79331888
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol
SMILESCOc1ccc(C2(O)C3CCCCC32)cc1
InChIInChI=1S/C14H18O2/c1-16-11-8-6-10(7-9-11)14(15)12-4-2-3-5-13(12)14/h6-9,12-13,15H,2-5H2,1H3
InChIKeyPYCQFRYGZMYOHG-UHFFFAOYSA-N
XLogP2.70
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-(2,4-dimethoxyphenyl)bicyclo[4.1.0]heptan-7-ol
CID 79331273
6-[(4-methoxyphenyl)methyl]bicyclo[3.1.0]hexan-6-ol
CID 79331242
1-(4-methoxyphenyl)-3-methylcyclohexan-1-ol
CID 60794519
cis-(1S,2S)-2-[(dimethylamino)methyl]-2-(4-methoxyphenyl)cyclohexan-1-ol
CID 58954914
2-(4-methoxyphenyl)-2-methylpiperidin-3-ol
CID 115032686
1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 55105917
(4aR,4bS,8aS,9aS)-9-(4-chlorophenyl)-1,2,3,4,4a,4b,5,6,7,8,8a,9a-dodecahydrofluoren-9-ol
CID 92533358
3-amino-3-(4-methoxyphenyl)cyclopentan-1-ol
CID 115025190
1-methoxy-4-[2-(4-methoxyphenyl)cyclohexyl]benzene
CID 101244821
9-[2-(4-methoxyphenyl)ethyl]bicyclo[6.1.0]nonan-1-ol
CID 78144176
8-(4-methoxyphenyl)spiro[4.5]decan-8-ol
CID 114819307
4-tert-butyl-1-(4-methoxyphenyl)cycloheptan-1-ol
CID 65094719

Frequently Asked Questions

What is the IUPAC name of 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol?
The IUPAC name of 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol (CID 79331888) is 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol.
What is the SMILES notation for 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol?
The canonical SMILES for 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol is COc1ccc(C2(O)C3CCCCC32)cc1.
What is the InChIKey of 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol?
The InChIKey is PYCQFRYGZMYOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c1-16-11-8-6-10(7-9-11)14(15)12-4-2-3-5-13(12)14/h6-9,12-13,15H,2-5H2,1H3.
What are the key properties of 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol?
7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol has a molecular weight of 218.30 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methoxyphenyl)bicyclo[4.1.0]heptan-7-ol is sourced from PubChem (CID 79331888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).