[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol

C15H22O — CID 116842604

IUPAC[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol
SMILESCC(C)c1ccc(C2(CO)CC2(C)C)cc1
InChIInChI=1S/C15H22O/c1-11(2)12-5-7-13(8-6-12)15(10-16)9-14(15,3)4/h5-8,11,16H,9-10H2,1-4H3
InChIKeyNYCQBGGOXRXUQI-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.47
Rot. Bonds3

About [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol

[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol (PubChem CID 116842604) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol
PubChem CID116842604
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol
SMILESCC(C)c1ccc(C2(CO)CC2(C)C)cc1
InChIInChI=1S/C15H22O/c1-11(2)12-5-7-13(8-6-12)15(10-16)9-14(15,3)4/h5-8,11,16H,9-10H2,1-4H3
InChIKeyNYCQBGGOXRXUQI-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(4-butan-2-ylphenyl)-2,2-dimethylcyclopropyl]methanol
CID 116842627
[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanamine
CID 83705516
[2,2-dimethyl-1-[4-(2-methylpropyl)phenyl]cyclopropyl]methanol
CID 116842625
[2,2-dimethyl-1-(4-propan-2-ylsulfanylphenyl)cyclopropyl]methanol
CID 116842695
2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropane-1-carboxylic acid
CID 83712978
3,3-dimethyl-1-(4-propan-2-ylphenyl)cyclopentan-1-ol
CID 80699700
3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
CID 103961176
1,1,3-trimethyl-5-propan-2-yl-3-(4-propan-2-ylphenyl)-2H-indene
CID 139620878
2-methyl-1-(4-propan-2-ylphenyl)cyclopropan-1-ol
CID 79332541
2,2,5,5-tetramethyl-3-[(4-propan-2-ylphenyl)methyl]oxolan-3-ol
CID 79928238
[1-[(4-propan-2-ylphenyl)methyl]cyclopentyl]methanol
CID 66026116
(1-methyl-6-propan-2-yl-2,3-dihydroinden-1-yl)methanol
CID 168723729

Frequently Asked Questions

What is the IUPAC name of [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol?
The IUPAC name of [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol (CID 116842604) is [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol.
What is the SMILES notation for [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol?
The canonical SMILES for [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol is CC(C)c1ccc(C2(CO)CC2(C)C)cc1.
What is the InChIKey of [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol?
The InChIKey is NYCQBGGOXRXUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-11(2)12-5-7-13(8-6-12)15(10-16)9-14(15,3)4/h5-8,11,16H,9-10H2,1-4H3.
What are the key properties of [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol?
[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol has a molecular weight of 218.34 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol is sourced from PubChem (CID 116842604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).