1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol

C13H17ClO2 — CID 117354237

IUPAC1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
SMILESCOc1c(Cl)cc(C(C)C)cc1C1(O)CC1
InChIInChI=1S/C13H17ClO2/c1-8(2)9-6-10(13(15)4-5-13)12(16-3)11(14)7-9/h6-8,15H,4-5H2,1-3H3
InChIKeyWFPPLVXMWRSVDW-UHFFFAOYSA-N
MW240.73 g/mol
LogP3.45
Rot. Bonds3

About 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol

1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol (PubChem CID 117354237) has the molecular formula C13H17ClO2 and a molecular weight of 240.73 g/mol. Its IUPAC name is 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
PubChem CID117354237
Molecular FormulaC13H17ClO2
Molecular Weight240.73 g/mol
Exact Mass240.09
IUPAC Name1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
SMILESCOc1c(Cl)cc(C(C)C)cc1C1(O)CC1
InChIInChI=1S/C13H17ClO2/c1-8(2)9-6-10(13(15)4-5-13)12(16-3)11(14)7-9/h6-8,15H,4-5H2,1-3H3
InChIKeyWFPPLVXMWRSVDW-UHFFFAOYSA-N
XLogP3.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol 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-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopentane-1-carboxylic acid
CID 117478165
1-(2-chloro-3-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
CID 117354231
1-(5-tert-butyl-3-chloro-2-methoxyphenyl)cyclopropan-1-ol
CID 117390180
1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)ethanol
CID 84692296
6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol
CID 84795724
1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)ethanone
CID 83892755
3-chloro-2-methoxy-5-propan-2-ylbenzohydrazide
CID 50882310
1-(3,5-dichloro-4-methoxyphenyl)propane-1,2-diol
CID 85213872
1-(2,3-dimethoxy-5-propan-2-ylphenyl)cyclopropan-1-amine
CID 117342983
1-(3-bromo-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-amine
CID 84812944
4-(1-hydroxycyclopropyl)-3-methoxy-2,6-dimethylphenol
CID 84780188
1-[1-(3-fluoro-2-methoxy-5-propan-2-ylphenyl)cyclopropyl]ethanamine
CID 117382009

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol (CID 117354237) is 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol is COc1c(Cl)cc(C(C)C)cc1C1(O)CC1.
What is the InChIKey of 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol?
The InChIKey is WFPPLVXMWRSVDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClO2/c1-8(2)9-6-10(13(15)4-5-13)12(16-3)11(14)7-9/h6-8,15H,4-5H2,1-3H3.
What are the key properties of 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol?
1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol has a molecular weight of 240.73 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 117354237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).