[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol

C13H18O2 — CID 116928851

IUPAC[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol
SMILESCCOc1ccc(CC2(CO)CC2)cc1
InChIInChI=1S/C13H18O2/c1-2-15-12-5-3-11(4-6-12)9-13(10-14)7-8-13/h3-6,14H,2,7-10H2,1H3
InChIKeyFESHQFMPAYHSBL-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.40
Rot. Bonds5

About [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol

[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol (PubChem CID 116928851) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol
PubChem CID116928851
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol
SMILESCCOc1ccc(CC2(CO)CC2)cc1
InChIInChI=1S/C13H18O2/c1-2-15-12-5-3-11(4-6-12)9-13(10-14)7-8-13/h3-6,14H,2,7-10H2,1H3
InChIKeyFESHQFMPAYHSBL-UHFFFAOYSA-N
XLogP2.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-[(4-ethoxyphenyl)methyl]oxetan-3-yl]methanol
CID 116930338
[1-[(4-ethylphenyl)methyl]cyclopropyl]methanol
CID 66025212
[1-[[(4-ethoxyphenyl)methyl-methylamino]methyl]cyclopropyl]methanol
CID 115243547
[1-[(4-propylphenyl)methyl]cyclopropyl]methanol
CID 116928838
[1-[[2-(4-ethoxyphenyl)ethyl-methylamino]methyl]cyclopropyl]methanol
CID 115243738
1-[1-[(4-ethoxyphenyl)methyl]cyclobutyl]-N-methylmethanamine
CID 116929393
[1-[(4-ethoxy-N-methylanilino)methyl]cyclopropyl]methanol
CID 115243346
1-[[1-(bromomethyl)cyclopropyl]methoxy]-4-ethoxybenzene
CID 65008315
[1-[(4-phenylphenyl)methyl]cyclopropyl]methanol
CID 116928854
3-[(4-ethoxyphenyl)methyl]pyrrolidin-3-ol
CID 83691018
(2S)-2-[(4-ethoxyphenyl)methyl]piperidine-2-carboxylic acid
CID 25030154
5-[(4-ethoxyphenyl)methyl]-5-methylpyrrolidin-2-one
CID 104687288

Frequently Asked Questions

What is the IUPAC name of [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol (CID 116928851) is [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol is CCOc1ccc(CC2(CO)CC2)cc1.
What is the InChIKey of [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol?
The InChIKey is FESHQFMPAYHSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-2-15-12-5-3-11(4-6-12)9-13(10-14)7-8-13/h3-6,14H,2,7-10H2,1H3.
What are the key properties of [1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol?
[1-[(4-ethoxyphenyl)methyl]cyclopropyl]methanol has a molecular weight of 206.28 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-ethoxyphenyl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 116928851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).