2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol

C17H26O2 — CID 106873705

IUPAC2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol
SMILESCOC1CCCCC1(O)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C17H26O2/c1-13(2)15-9-7-14(8-10-15)12-17(18)11-5-4-6-16(17)19-3/h7-10,13,16,18H,4-6,11-12H2,1-3H3
InChIKeySHYKTGYWARLKST-UHFFFAOYSA-N
MW262.39 g/mol
LogP3.67
Rot. Bonds4

About 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol

2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol (PubChem CID 106873705) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol
PubChem CID106873705
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol
SMILESCOC1CCCCC1(O)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C17H26O2/c1-13(2)15-9-7-14(8-10-15)12-17(18)11-5-4-6-16(17)19-3/h7-10,13,16,18H,4-6,11-12H2,1-3H3
InChIKeySHYKTGYWARLKST-UHFFFAOYSA-N
XLogP3.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4-chlorophenyl)methyl]-2-methoxycyclohexan-1-ol
CID 106873721
2-methyl-3-[(4-propan-2-ylphenyl)methyl]thian-3-ol
CID 79952167
[1-[(4-propan-2-ylphenyl)methyl]cyclopentyl]methanol
CID 66026116
[1-[(4-propan-2-ylphenyl)methyl]cyclohexyl]methanol
CID 66024781
2-methoxy-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclohexan-1-ol
CID 106873747
4-[(4-propan-2-ylphenyl)methyl]-1-azabicyclo[3.2.1]octan-4-ol
CID 105365757
2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol
CID 106873763
3,4-dimethyl-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol
CID 65154218
4-tert-butyl-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol
CID 65147785
trans-(1S,2R)-1-(3-hydroxypropyl)-2-methoxycyclohexan-1-ol
CID 98010257
2-(1-hydroxy-2-methoxycyclohexyl)acetaldehyde
CID 106875208
1-[(4-propan-2-ylphenyl)methyl]-4-propylcyclohexan-1-ol
CID 65147469

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol?
The IUPAC name of 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol (CID 106873705) is 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol?
The canonical SMILES for 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol is COC1CCCCC1(O)Cc1ccc(C(C)C)cc1.
What is the InChIKey of 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol?
The InChIKey is SHYKTGYWARLKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-13(2)15-9-7-14(8-10-15)12-17(18)11-5-4-6-16(17)19-3/h7-10,13,16,18H,4-6,11-12H2,1-3H3.
What are the key properties of 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol?
2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol has a molecular weight of 262.39 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-[(4-propan-2-ylphenyl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 106873705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).