2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol

C15H22O2 — CID 116712968

IUPAC2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
SMILESCCOC(C1CC1)C(O)c1cc(C)ccc1C
InChIInChI=1S/C15H22O2/c1-4-17-15(12-7-8-12)14(16)13-9-10(2)5-6-11(13)3/h5-6,9,12,14-16H,4,7-8H2,1-3H3
InChIKeyWXIQKWZTTQYMMH-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.15
Rot. Bonds5

About 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol

2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol (PubChem CID 116712968) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol.

Molecular Properties

Compound Name2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
PubChem CID116712968
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
SMILESCCOC(C1CC1)C(O)c1cc(C)ccc1C
InChIInChI=1S/C15H22O2/c1-4-17-15(12-7-8-12)14(16)13-9-10(2)5-6-11(13)3/h5-6,9,12,14-16H,4,7-8H2,1-3H3
InChIKeyWXIQKWZTTQYMMH-UHFFFAOYSA-N
XLogP3.15
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116756745
2-cyclopropyl-2-ethoxy-1-(4-methoxy-2,5-dimethylphenyl)ethanol
CID 116712960
1-(2,5-dimethylphenyl)-2-ethoxybutan-1-ol
CID 116711234
1-cyclopropyl-3-(2,5-dimethylphenyl)-1-ethoxypropan-2-amine
CID 116723227
1-(2-amino-5-methyl-3-pyridinyl)-2-cyclohexyl-2-ethoxyethanol
CID 116756726
1-(2,5-dimethylphenyl)-2-ethylbutan-1-ol
CID 61088457
1-(2-cyclobutylphenyl)-2-cyclopropyl-2-ethoxyethanol
CID 114602475
2-cyclopropyl-2-ethoxy-1-(3-ethoxyphenyl)ethanol
CID 116712902
2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine
CID 116721972
2-cyclopropyl-2-ethoxy-1-[4-(trifluoromethyl)-3-pyridinyl]ethanol
CID 102707917
1-cyclopropyl-3-(2,5-dimethylphenyl)-1-methoxypropan-2-ol
CID 116712602
1-(3-chlorothiophen-2-yl)-2-cyclopropyl-2-ethoxyethanol
CID 107359630

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
The IUPAC name of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol (CID 116712968) is 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol.
What is the SMILES notation for 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
The canonical SMILES for 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol is CCOC(C1CC1)C(O)c1cc(C)ccc1C.
What is the InChIKey of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
The InChIKey is WXIQKWZTTQYMMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-4-17-15(12-7-8-12)14(16)13-9-10(2)5-6-11(13)3/h5-6,9,12,14-16H,4,7-8H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol?
2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol has a molecular weight of 234.34 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol is sourced from PubChem (CID 116712968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).