(5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane

C15H24O2 — CID 156749426

IUPAC(5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane
SMILESCC.CCOc1cc(C)c(C2CC2)cc1CO
InChIInChI=1S/C13H18O2.C2H6/c1-3-15-13-6-9(2)12(10-4-5-10)7-11(13)8-14;1-2/h6-7,10,14H,3-5,8H2,1-2H3;1-2H3
InChIKeyWUBLLWMMPRDDPT-UHFFFAOYSA-N
MW236.35 g/mol
LogP3.79
Rot. Bonds4

About (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane

(5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane (PubChem CID 156749426) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane.

Molecular Properties

Compound Name(5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane
PubChem CID156749426
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name(5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane
SMILESCC.CCOc1cc(C)c(C2CC2)cc1CO
InChIInChI=1S/C13H18O2.C2H6/c1-3-15-13-6-9(2)12(10-4-5-10)7-11(13)8-14;1-2/h6-7,10,14H,3-5,8H2,1-2H3;1-2H3
InChIKeyWUBLLWMMPRDDPT-UHFFFAOYSA-N
XLogP3.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethoxy-4,5-dimethylphenyl)methanol
CID 131316252
4-(4-ethoxy-2,5-dimethylphenyl)azepane
CID 82296026
4-(5-chloro-4-ethoxy-2-methylphenyl)azepane
CID 82304982
(5-ethoxy-2-methyl-4-pyridinyl)methanol
CID 118425671
4-cyclohexyl-5-ethoxy-2-methylphenol
CID 59929209
[5-cyclopropyl-2-ethoxy-6-(4-fluorophenyl)-3-pyridinyl]methanol
CID 130388081
(6,13-diethoxy-12,19-dimethoxy-20-methyl-5-tetracyclo[15.4.0.03,8.010,15]henicosa-1(17),3,5,7,10,12,14,18,20-nonaenyl)methanol;formaldehyde
CID 159665762
methyl 3-cyclopropyl-5-ethoxy-4-iodobenzoate
CID 90423123
2-(2,5-diethoxy-4-methylphenyl)acetic acid
CID 4286018
ethyl 2-cyclopropyl-5-ethoxy-4-fluorobenzoate
CID 90422988
2-ethoxy-4,5-dimethylphenol
CID 82053903
4-[4-ethoxy-3-(hydroxymethyl)anilino]cyclohexan-1-ol
CID 106594412

Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane?
The IUPAC name of (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane (CID 156749426) is (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane.
What is the SMILES notation for (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane?
The canonical SMILES for (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane is CC.CCOc1cc(C)c(C2CC2)cc1CO.
What is the InChIKey of (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane?
The InChIKey is WUBLLWMMPRDDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2.C2H6/c1-3-15-13-6-9(2)12(10-4-5-10)7-11(13)8-14;1-2/h6-7,10,14H,3-5,8H2,1-2H3;1-2H3.
What are the key properties of (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane?
(5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane has a molecular weight of 236.35 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopropyl-2-ethoxy-4-methylphenyl)methanol;ethane is sourced from PubChem (CID 156749426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).