1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol

C16H26O — CID 163611370

IUPAC1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)C1C=CC(C2CCCCC2)=CC1
InChIInChI=1S/C16H26O/c1-12(2)16(17)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-10,12-13,15-17H,3-7,11H2,1-2H3
InChIKeyHGFBXXPJSSIIIA-UHFFFAOYSA-N
MW234.38 g/mol
LogP4.09
Rot. Bonds3

About 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol

1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol (PubChem CID 163611370) has the molecular formula C16H26O and a molecular weight of 234.38 g/mol. Its IUPAC name is 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol
PubChem CID163611370
Molecular FormulaC16H26O
Molecular Weight234.38 g/mol
Exact Mass234.20
IUPAC Name1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)C1C=CC(C2CCCCC2)=CC1
InChIInChI=1S/C16H26O/c1-12(2)16(17)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-10,12-13,15-17H,3-7,11H2,1-2H3
InChIKeyHGFBXXPJSSIIIA-UHFFFAOYSA-N
XLogP4.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.38
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[4,5-di(propan-2-yl)cyclopenta-1,4-dien-1-yl]cyclohexane
CID 23295273
2-(4-methylcyclohex-2-en-1-yl)-5-propan-2-ylcyclohexa-1,3-diene
CID 162365229
(4-cyclopropylcyclohexa-2,4-dien-1-yl)boronic acid
CID 167506576
3-cyclopentyl-1-propan-2-ylcyclopenta-1,3-diene
CID 159952981
1-[3-cyclohexyl-1-(diethylamino)thiophen-1-yl]-2-methylpropan-1-ol
CID 56981145
2-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-8,14,20-tris(4-cyclohexylphenyl)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-4,6,10,12,16,18,22,24-octol
CID 123811633
(4-propan-2-ylcyclohexa-1,5-dien-1-yl)methanol
CID 519721
5-(3,3-dimethylbutan-2-yl)-2-methylcyclohexa-1,3-diene
CID 157406812
1-[3-cyclohexyl-1-(ethylamino)thiophen-1-yl]propan-2-ol
CID 57123147
1-cycloheptylpropane-1,2-diol
CID 103452573
1,3-dicyclohexyl-5-phenyl-2,4,6-tri(propan-2-yl)benzene
CID 175032315
(1-bromo-2-methylpropyl)cyclododecane
CID 79298781

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol?
The IUPAC name of 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol (CID 163611370) is 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol?
The canonical SMILES for 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol is CC(C)C(O)C1C=CC(C2CCCCC2)=CC1.
What is the InChIKey of 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol?
The InChIKey is HGFBXXPJSSIIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O/c1-12(2)16(17)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-10,12-13,15-17H,3-7,11H2,1-2H3.
What are the key properties of 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol?
1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol has a molecular weight of 234.38 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylcyclohexa-2,4-dien-1-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 163611370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).