[1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol

C14H20O3 — CID 116928883

IUPAC[1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol
SMILESCOc1cc(CC2(CO)CC2)c(OC)cc1C
InChIInChI=1S/C14H20O3/c1-10-6-13(17-3)11(7-12(10)16-2)8-14(9-15)4-5-14/h6-7,15H,4-5,8-9H2,1-3H3
InChIKeyAQEBJWDLKWXLJM-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.33
Rot. Bonds5

About [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol

[1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol (PubChem CID 116928883) has the molecular formula C14H20O3 and a molecular weight of 236.31 g/mol. Its IUPAC name is [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol
PubChem CID116928883
Molecular FormulaC14H20O3
Molecular Weight236.31 g/mol
Exact Mass236.14
IUPAC Name[1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol
SMILESCOc1cc(CC2(CO)CC2)c(OC)cc1C
InChIInChI=1S/C14H20O3/c1-10-6-13(17-3)11(7-12(10)16-2)8-14(9-15)4-5-14/h6-7,15H,4-5,8-9H2,1-3H3
InChIKeyAQEBJWDLKWXLJM-UHFFFAOYSA-N
XLogP2.33
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[(2,5-dimethoxy-4-methylphenyl)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

[1-[(5-bromo-2-methoxyphenyl)methyl]cyclopropyl]methanol
CID 66023451
[1-[(4-methoxy-N,2,5-trimethylanilino)methyl]cyclopropyl]methanol
CID 115243345
[1-[(2,4,6-trimethoxyphenyl)methyl]cyclopropyl]methanol
CID 116928893
1-[(5-ethoxy-2-methoxy-4-methylphenyl)methyl]cyclopropan-1-ol
CID 117345254
[1-[(5-bromo-2-methoxyphenyl)methyl]cyclobutyl]methanol
CID 66026762
1-[(4,5-dimethoxy-2-methylphenyl)methyl]cyclopropan-1-amine
CID 105423331
[1-[(4-tert-butyl-2-methylphenyl)methyl]cyclopropyl]methanol
CID 116928903
[3-[(2-methoxy-5-methylphenyl)methyl]oxolan-3-yl]methanol
CID 66059005
1-[(4,5-dimethoxy-2-methylphenyl)methyl]cyclobutane-1-carboxylic acid
CID 116929511
[1-[3-(2-methoxy-4,5-dimethylphenyl)oxetan-3-yl]cyclopropyl]methanol
CID 116874726
[1-[(2-methoxy-3,4,6-trimethylphenyl)methyl]cyclopropyl]methanol
CID 116928935
1-[3-(2,5-dimethoxy-4-methylphenyl)propyl]-2,5-dimethoxy-4-methylbenzene
CID 4096780

Frequently Asked Questions

What is the IUPAC name of [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol (CID 116928883) is [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol is COc1cc(CC2(CO)CC2)c(OC)cc1C.
What is the InChIKey of [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol?
The InChIKey is AQEBJWDLKWXLJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O3/c1-10-6-13(17-3)11(7-12(10)16-2)8-14(9-15)4-5-14/h6-7,15H,4-5,8-9H2,1-3H3.
What are the key properties of [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol?
[1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol has a molecular weight of 236.31 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 116928883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).