[1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane

C21H38O — CID 175608625

IUPAC[1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane
SMILESCC1C(C)(C)C1(C)C(C)(OC1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H38O/c1-16-19(2,3)20(16,4)21(5,17-12-8-6-9-13-17)22-18-14-10-7-11-15-18/h16-18H,6-15H2,1-5H3
InChIKeyYUOBYAZRMBOVMS-UHFFFAOYSA-N
MW306.53 g/mol
LogP6.36
Rot. Bonds4

About [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane

[1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane (PubChem CID 175608625) has the molecular formula C21H38O and a molecular weight of 306.53 g/mol. Its IUPAC name is [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane.

Molecular Properties

Compound Name[1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane
PubChem CID175608625
Molecular FormulaC21H38O
Molecular Weight306.53 g/mol
Exact Mass306.29
IUPAC Name[1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane
SMILESCC1C(C)(C)C1(C)C(C)(OC1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H38O/c1-16-19(2,3)20(16,4)21(5,17-12-8-6-9-13-17)22-18-14-10-7-11-15-18/h16-18H,6-15H2,1-5H3
InChIKeyYUOBYAZRMBOVMS-UHFFFAOYSA-N
XLogP6.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.53
LogP ≤ 56.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-cyclohexyloxy-1-methylcyclohexane
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2-cyclohexyloxy-N,N-dimethylpropan-2-amine
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4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol
CID 163964872
1-[cyclohexyloxy(difluoro)methyl]-4-methylcyclohexane
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2-cyclohexyloxy-2-cyclopropylpropanoic acid
CID 82238646
tert-butylcyclopentadecane
CID 164774831
tricyclohexylmethylsilane
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CID 173025587
CID 173025587

Frequently Asked Questions

What is the IUPAC name of [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane?
The IUPAC name of [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane (CID 175608625) is [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane.
What is the SMILES notation for [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane?
The canonical SMILES for [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane is CC1C(C)(C)C1(C)C(C)(OC1CCCCC1)C1CCCCC1.
What is the InChIKey of [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane?
The InChIKey is YUOBYAZRMBOVMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38O/c1-16-19(2,3)20(16,4)21(5,17-12-8-6-9-13-17)22-18-14-10-7-11-15-18/h16-18H,6-15H2,1-5H3.
What are the key properties of [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane?
[1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane has a molecular weight of 306.53 g/mol, XLogP of 6.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclohexyloxy-1-(1,2,2,3-tetramethylcyclopropyl)ethyl]cyclohexane is sourced from PubChem (CID 175608625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).