(1-cyclohexyl-4-methylpentyl)cyclohexane

C18H34 — CID 21259623

IUPAC(1-cyclohexyl-4-methylpentyl)cyclohexane
SMILESCC(C)CCC(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H34/c1-15(2)13-14-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h15-18H,3-14H2,1-2H3
InChIKeyYRUHJNJHZNYYBC-UHFFFAOYSA-N
MW250.47 g/mol
LogP6.20
Rot. Bonds5

About (1-cyclohexyl-4-methylpentyl)cyclohexane

(1-cyclohexyl-4-methylpentyl)cyclohexane (PubChem CID 21259623) has the molecular formula C18H34 and a molecular weight of 250.47 g/mol. Its IUPAC name is (1-cyclohexyl-4-methylpentyl)cyclohexane.

Molecular Properties

Compound Name(1-cyclohexyl-4-methylpentyl)cyclohexane
PubChem CID21259623
Molecular FormulaC18H34
Molecular Weight250.47 g/mol
Exact Mass250.27
IUPAC Name(1-cyclohexyl-4-methylpentyl)cyclohexane
SMILESCC(C)CCC(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H34/c1-15(2)13-14-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h15-18H,3-14H2,1-2H3
InChIKeyYRUHJNJHZNYYBC-UHFFFAOYSA-N
XLogP6.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.47
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane
CID 59268412
1-cyclopropylpentylcycloheptane
CID 91177068
7-methyloctan-2-ylcyclohexane
CID 54518526
1-cycloheptyldecylcycloheptane
CID 20559033
1-cyclohexylheptylcyclohexane
CID 16404
1-cyclooctyl-5-methylhexan-1-amine
CID 83162244
1-cycloheptyl-5-methylhexan-2-ol
CID 115783773
3,3-dicyclohexyl-N-(3-methylbutyl)propanamide
CID 171725760
1-amino-1-cyclohexyl-6-methylheptan-3-ol
CID 22367824
(1-cyclohexyl-2-fluoroethyl)cyclohexane
CID 162165643
methane;propan-2-ylcyclotetradecane
CID 159882779
1-cyclopentylethylcyclohexane
CID 57034702

Frequently Asked Questions

What is the IUPAC name of (1-cyclohexyl-4-methylpentyl)cyclohexane?
The IUPAC name of (1-cyclohexyl-4-methylpentyl)cyclohexane (CID 21259623) is (1-cyclohexyl-4-methylpentyl)cyclohexane.
What is the SMILES notation for (1-cyclohexyl-4-methylpentyl)cyclohexane?
The canonical SMILES for (1-cyclohexyl-4-methylpentyl)cyclohexane is CC(C)CCC(C1CCCCC1)C1CCCCC1.
What is the InChIKey of (1-cyclohexyl-4-methylpentyl)cyclohexane?
The InChIKey is YRUHJNJHZNYYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34/c1-15(2)13-14-18(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h15-18H,3-14H2,1-2H3.
What are the key properties of (1-cyclohexyl-4-methylpentyl)cyclohexane?
(1-cyclohexyl-4-methylpentyl)cyclohexane has a molecular weight of 250.47 g/mol, XLogP of 6.20, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclohexyl-4-methylpentyl)cyclohexane is sourced from PubChem (CID 21259623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).