1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol

C15H20Cl2O — CID 65154379

IUPAC1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol
SMILESCC1CC(C)CC(O)(Cc2ccc(Cl)cc2Cl)C1
InChIInChI=1S/C15H20Cl2O/c1-10-5-11(2)8-15(18,7-10)9-12-3-4-13(16)6-14(12)17/h3-4,6,10-11,18H,5,7-9H2,1-2H3
InChIKeyIKCHAOUIMSCTOB-UHFFFAOYSA-N
MW287.23 g/mol
LogP4.72
Rot. Bonds2

About 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol

1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol (PubChem CID 65154379) has the molecular formula C15H20Cl2O and a molecular weight of 287.23 g/mol. Its IUPAC name is 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol
PubChem CID65154379
Molecular FormulaC15H20Cl2O
Molecular Weight287.23 g/mol
Exact Mass286.09
IUPAC Name1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol
SMILESCC1CC(C)CC(O)(Cc2ccc(Cl)cc2Cl)C1
InChIInChI=1S/C15H20Cl2O/c1-10-5-11(2)8-15(18,7-10)9-12-3-4-13(16)6-14(12)17/h3-4,6,10-11,18H,5,7-9H2,1-2H3
InChIKeyIKCHAOUIMSCTOB-UHFFFAOYSA-N
XLogP4.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.23
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64753224
3-[(2,4-dichlorophenyl)methyl]oxetan-3-ol
CID 164649438
1-[(2,4-dichlorophenyl)methyl]-2-methylcyclopropan-1-amine
CID 79333265
1-[(2,4-dichlorophenyl)methyl]-3-propan-2-ylcyclohexan-1-ol
CID 107449760
4-[(2,4-dichlorophenyl)methyl]-2-ethyloxan-4-ol
CID 65149416
1-[(2,4-dichlorophenyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 70921617
1-[(4-bromo-2-chlorophenyl)methyl]-3-methoxycyclobutan-1-ol
CID 106823811
1-[(2,5-dichlorophenyl)methyl]-3,4-dimethylcyclohexan-1-ol
CID 65316674
1-[(2-methoxy-5-methylphenyl)methyl]-3,5-dimethylcyclohexan-1-ol
CID 64736144
1-[(5-chloro-2-fluorophenyl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 103047881
2-(chloromethyl)-2-[(2,4-dichlorophenyl)methyl]bicyclo[2.2.1]heptane
CID 66033954
1-[1-[(2,4-dichlorophenyl)methyl]cyclopropyl]ethanol
CID 106798312

Frequently Asked Questions

What is the IUPAC name of 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol?
The IUPAC name of 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol (CID 65154379) is 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol.
What is the SMILES notation for 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol?
The canonical SMILES for 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol is CC1CC(C)CC(O)(Cc2ccc(Cl)cc2Cl)C1.
What is the InChIKey of 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol?
The InChIKey is IKCHAOUIMSCTOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2O/c1-10-5-11(2)8-15(18,7-10)9-12-3-4-13(16)6-14(12)17/h3-4,6,10-11,18H,5,7-9H2,1-2H3.
What are the key properties of 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol?
1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol has a molecular weight of 287.23 g/mol, XLogP of 4.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylcyclohexan-1-ol is sourced from PubChem (CID 65154379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).