2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol

C14H20O2 — CID 117314647

IUPAC2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol
SMILESCc1ccc(CCO)c(OCC2CC2)c1C
InChIInChI=1S/C14H20O2/c1-10-3-6-13(7-8-15)14(11(10)2)16-9-12-4-5-12/h3,6,12,15H,4-5,7-9H2,1-2H3
InChIKeyNWDUQCXOCSYIIH-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.63
Rot. Bonds5

About 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol

2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol (PubChem CID 117314647) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol.

Molecular Properties

Compound Name2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol
PubChem CID117314647
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol
SMILESCc1ccc(CCO)c(OCC2CC2)c1C
InChIInChI=1S/C14H20O2/c1-10-3-6-13(7-8-15)14(11(10)2)16-9-12-4-5-12/h3,6,12,15H,4-5,7-9H2,1-2H3
InChIKeyNWDUQCXOCSYIIH-UHFFFAOYSA-N
XLogP2.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

O-[2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethyl]hydroxylamine
CID 117343414
1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-ol
CID 117336720
1-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]cyclopropan-1-amine
CID 84794783
ethyl 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]-2-oxoacetate
CID 117442405
2-[2-bromo-4-(cyclopropylmethoxy)phenyl]ethanol
CID 151817566
3-[(2,3,6-trimethylphenoxy)methyl]azetidine
CID 116820174
6-amino-2-(cyclopropylmethoxy)-3,4-dimethylphenol
CID 84675296
2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]-2-methylpyrrolidine
CID 117402832
1-(bromomethyl)-4-(cyclopropylmethoxy)-2-methylbenzene
CID 68763979
2-(cyclopropylmethoxy)-1-(1-isocyanatocyclobutyl)-3,4-dimethylbenzene
CID 117431403
4-[(2,3,4-trimethylphenoxy)methyl]piperidin-1-ide;yttrium(3+)
CID 21036652
[4-(cyclobutylmethoxy)-3,5-dimethylphenyl]methanol
CID 65457601

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol?
The IUPAC name of 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol (CID 117314647) is 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol.
What is the SMILES notation for 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol?
The canonical SMILES for 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol is Cc1ccc(CCO)c(OCC2CC2)c1C.
What is the InChIKey of 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol?
The InChIKey is NWDUQCXOCSYIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-10-3-6-13(7-8-15)14(11(10)2)16-9-12-4-5-12/h3,6,12,15H,4-5,7-9H2,1-2H3.
What are the key properties of 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol?
2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol has a molecular weight of 220.31 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopropylmethoxy)-3,4-dimethylphenyl]ethanol is sourced from PubChem (CID 117314647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).