1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol

C15H20O2 — CID 117336720

IUPAC1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol
SMILESCc1ccc(C2(O)CC2)c(OCC2CC2)c1C
InChIInChI=1S/C15H20O2/c1-10-3-6-13(15(16)7-8-15)14(11(10)2)17-9-12-4-5-12/h3,6,12,16H,4-5,7-9H2,1-2H3
InChIKeyVICWLCUCKKHBNT-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.07
Rot. Bonds4

About 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol

1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol (PubChem CID 117336720) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol
PubChem CID117336720
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol
SMILESCc1ccc(C2(O)CC2)c(OCC2CC2)c1C
InChIInChI=1S/C15H20O2/c1-10-3-6-13(15(16)7-8-15)14(11(10)2)17-9-12-4-5-12/h3,6,12,16H,4-5,7-9H2,1-2H3
InChIKeyVICWLCUCKKHBNT-UHFFFAOYSA-N
XLogP3.07
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]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-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-amine
CID 84794783
2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]-2-methylpyrrolidine
CID 117402832
4-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol
CID 103432415
2-(cyclopropylmethoxy)-1-(1-isocyanatocyclobutyl)-3,4-dimethylbenzene
CID 117431403
2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol
CID 117314647
8-(2-methoxy-3,4-dimethylphenyl)spiro[4.5]decan-8-ol
CID 103432732
3-ethyl-1-(2-methoxy-3,4-dimethylphenyl)cyclohexan-1-ol
CID 103432568
ethyl 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]-2-oxoacetate
CID 117442405
O-[2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethyl]hydroxylamine
CID 117343414
1-(2-methoxy-3,4-dimethylphenyl)-3,3-dimethylcyclopentan-1-ol
CID 103432648
1-[4-(cyclopropylmethoxy)phenyl]cyclopropan-1-ol
CID 117292728
3-[(2,3,6-trimethylphenoxy)methyl]azetidine
CID 116820174

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol?
The IUPAC name of 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol (CID 117336720) is 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol?
The canonical SMILES for 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol is Cc1ccc(C2(O)CC2)c(OCC2CC2)c1C.
What is the InChIKey of 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol?
The InChIKey is VICWLCUCKKHBNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-10-3-6-13(15(16)7-8-15)14(11(10)2)17-9-12-4-5-12/h3,6,12,16H,4-5,7-9H2,1-2H3.
What are the key properties of 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol?
1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol has a molecular weight of 232.32 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol is sourced from PubChem (CID 117336720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).