1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol

C16H24O2 — CID 106679681

IUPAC1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
SMILESCOc1cc(C)cc(C)c1C1(O)CCCC1(C)C
InChIInChI=1S/C16H24O2/c1-11-9-12(2)14(13(10-11)18-5)16(17)8-6-7-15(16,3)4/h9-10,17H,6-8H2,1-5H3
InChIKeyMWWRPWIBWZWISI-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.71
Rot. Bonds2

About 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol

1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol (PubChem CID 106679681) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
PubChem CID106679681
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
SMILESCOc1cc(C)cc(C)c1C1(O)CCCC1(C)C
InChIInChI=1S/C16H24O2/c1-11-9-12(2)14(13(10-11)18-5)16(17)8-6-7-15(16,3)4/h9-10,17H,6-8H2,1-5H3
InChIKeyMWWRPWIBWZWISI-UHFFFAOYSA-N
XLogP3.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methoxy-4,6-dimethylphenyl)-1-methylpiperidin-3-ol
CID 106679716
1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylcyclohexan-1-ol
CID 106679636
1-(2-methoxy-4,6-dimethylphenyl)-3,4-dimethylcyclohexan-1-ol
CID 106679635
1-(2,5-dimethoxyphenyl)-2,2-dimethylcyclopentan-1-ol
CID 79862324
methyl 1-(2-methoxy-4,6-dimethylphenyl)cyclopropane-1-carboxylate
CID 116964011
1-(2,5-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol
CID 79863052
1-(2-methoxy-4,6-dimethylphenyl)-3,4-dimethylcyclohexan-1-amine
CID 106679860
2-[3-(2-methoxy-4,6-dimethylphenyl)oxetan-3-yl]pyrrolidine
CID 116870822
1-[3-(2-methoxy-4,6-dimethylphenyl)oxetan-3-yl]propan-2-one
CID 116873850
1-(2-methoxy-4,6-dimethylphenyl)-4-methylcycloheptan-1-amine
CID 106679866
1-(2-fluoro-3-methoxyphenyl)-2,2-dimethylcyclohexan-1-ol
CID 82806761
(1-methoxycyclobutyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106680299

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol (CID 106679681) is 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol is COc1cc(C)cc(C)c1C1(O)CCCC1(C)C.
What is the InChIKey of 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
The InChIKey is MWWRPWIBWZWISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-11-9-12(2)14(13(10-11)18-5)16(17)8-6-7-15(16,3)4/h9-10,17H,6-8H2,1-5H3.
What are the key properties of 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol?
1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 106679681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).