[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol

C13H18O2 — CID 81358295

IUPAC[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol
SMILESCCOc1ccc(C2(C)CC2CO)cc1
InChIInChI=1S/C13H18O2/c1-3-15-12-6-4-10(5-7-12)13(2)8-11(13)9-14/h4-7,11,14H,3,8-9H2,1-2H3
InChIKeyPVVSVSNKRYFNNK-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.36
Rot. Bonds4

About [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol

[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol (PubChem CID 81358295) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol.

Molecular Properties

Compound Name[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol
PubChem CID81358295
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol
SMILESCCOc1ccc(C2(C)CC2CO)cc1
InChIInChI=1S/C13H18O2/c1-3-15-12-6-4-10(5-7-12)13(2)8-11(13)9-14/h4-7,11,14H,3,8-9H2,1-2H3
InChIKeyPVVSVSNKRYFNNK-UHFFFAOYSA-N
XLogP2.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S,2R)-2-methyl-2-phenylcyclopropyl]methanol
CID 15781967
1-(4-ethoxyphenyl)-2-methylcyclopropan-1-ol
CID 79332202
1-(4-ethoxyphenyl)-2,2-dimethylcyclopropan-1-amine
CID 83701496
3-(4-ethoxyphenyl)-2-ethyl-3-methylpyrrolidine
CID 62352999
1-(4-ethoxyphenyl)-3-propan-2-ylcyclobutan-1-amine
CID 65016935
2-(4-ethoxyphenyl)-2-methyl-1,3-dioxolane
CID 82126602
2-(4-ethoxyphenyl)-2-methylpyrrolidine
CID 66467822
3-(4-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-ol
CID 81468333
3-amino-1-(4-ethoxyphenyl)cyclopentan-1-ol
CID 80561943
[2-chloro-1-(4-ethoxyphenyl)cyclopropyl]methanamine
CID 54376856
1-(1,2-dimethylcyclopropyl)-4-pentoxybenzene
CID 155310542
1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol
CID 62788999

Frequently Asked Questions

What is the IUPAC name of [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol?
The IUPAC name of [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol (CID 81358295) is [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol.
What is the SMILES notation for [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol?
The canonical SMILES for [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol is CCOc1ccc(C2(C)CC2CO)cc1.
What is the InChIKey of [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol?
The InChIKey is PVVSVSNKRYFNNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-3-15-12-6-4-10(5-7-12)13(2)8-11(13)9-14/h4-7,11,14H,3,8-9H2,1-2H3.
What are the key properties of [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol?
[2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol has a molecular weight of 206.28 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethoxyphenyl)-2-methylcyclopropyl]methanol is sourced from PubChem (CID 81358295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).