[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol

C17H20O2 — CID 62124011

IUPAC[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol
SMILESCc1cc(CO)ccc1Oc1ccccc1C(C)C
InChIInChI=1S/C17H20O2/c1-12(2)15-6-4-5-7-17(15)19-16-9-8-14(11-18)10-13(16)3/h4-10,12,18H,11H2,1-3H3
InChIKeyLEEVAQVYZQCNDI-UHFFFAOYSA-N
MW256.35 g/mol
LogP4.40
Rot. Bonds4

About [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol

[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol (PubChem CID 62124011) has the molecular formula C17H20O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol
PubChem CID62124011
Molecular FormulaC17H20O2
Molecular Weight256.35 g/mol
Exact Mass256.15
IUPAC Name[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol
SMILESCc1cc(CO)ccc1Oc1ccccc1C(C)C
InChIInChI=1S/C17H20O2/c1-12(2)15-6-4-5-7-17(15)19-16-9-8-14(11-18)10-13(16)3/h4-10,12,18H,11H2,1-3H3
InChIKeyLEEVAQVYZQCNDI-UHFFFAOYSA-N
XLogP4.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]ethanamine
CID 63803808
[4-(2-ethylphenoxy)-3-methylphenyl]methanol
CID 62125436
[4-(2-butan-2-ylphenoxy)-3-methylphenyl]methanamine
CID 63458562
(4-methyl-3-propan-2-ylphenyl)methanol
CID 20871908
[4-(2-chloro-4-methylphenoxy)-3-methylphenyl]methanol
CID 62673606
4-(chloromethyl)-2-fluoro-1-(2-propan-2-ylphenoxy)benzene
CID 28947258
(1R)-1-[2-(4-tert-butyl-2-methylphenoxy)phenyl]ethanol
CID 78944803
2-chloro-5-methyl-4-(2-propan-2-ylphenoxy)aniline
CID 115555233
(3-methyl-4-pyridin-3-yloxyphenyl)methanol
CID 62124917
[4-(4-bromo-2-chlorophenoxy)-3-methylphenyl]methanol
CID 63540802
2,4-difluoro-1-(2-propan-2-ylphenoxy)benzene
CID 54486908
N-[[3-methyl-4-(2-methylphenoxy)phenyl]methyl]ethanamine
CID 63552188

Frequently Asked Questions

What is the IUPAC name of [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol?
The IUPAC name of [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol (CID 62124011) is [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol.
What is the SMILES notation for [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol?
The canonical SMILES for [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol is Cc1cc(CO)ccc1Oc1ccccc1C(C)C.
What is the InChIKey of [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol?
The InChIKey is LEEVAQVYZQCNDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-12(2)15-6-4-5-7-17(15)19-16-9-8-14(11-18)10-13(16)3/h4-10,12,18H,11H2,1-3H3.
What are the key properties of [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol?
[3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol has a molecular weight of 256.35 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-4-(2-propan-2-ylphenoxy)phenyl]methanol is sourced from PubChem (CID 62124011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).