1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane

C24H46 — CID 59268412

IUPAC1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane
SMILESCC(C)CCC(C1CCC(C(C)C)CC1)C1CCC(C(C)C)CC1
InChIInChI=1S/C24H46/c1-17(2)7-16-24(22-12-8-20(9-13-22)18(3)4)23-14-10-21(11-15-23)19(5)6/h17-24H,7-16H2,1-6H3
InChIKeyMHNGCDGOOITJSF-UHFFFAOYSA-N
MW334.63 g/mol
LogP7.96
Rot. Bonds7

About 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane

1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane (PubChem CID 59268412) has the molecular formula C24H46 and a molecular weight of 334.63 g/mol. Its IUPAC name is 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane.

Molecular Properties

Compound Name1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane
PubChem CID59268412
Molecular FormulaC24H46
Molecular Weight334.63 g/mol
Exact Mass334.36
IUPAC Name1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane
SMILESCC(C)CCC(C1CCC(C(C)C)CC1)C1CCC(C(C)C)CC1
InChIInChI=1S/C24H46/c1-17(2)7-16-24(22-12-8-20(9-13-22)18(3)4)23-14-10-21(11-15-23)19(5)6/h17-24H,7-16H2,1-6H3
InChIKeyMHNGCDGOOITJSF-UHFFFAOYSA-N
XLogP7.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.63
LogP ≤ 57.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-cyclohexyl-4-methylpentyl)cyclohexane
CID 21259623
propan-2-ylcyclopropane;hydroiodide
CID 162314014
5-methyl-1-(4-propan-2-ylcyclohexyl)hexan-1-amine
CID 83161046
1-propan-2-yl-4-[2-(4-propan-2-ylcyclohexyl)ethyl]cyclohexane
CID 154060378
2-(3-methylbutyl)-4-propan-2-ylcyclohexan-1-amine
CID 63401726
2-N,2-N-bis(3-methylbutyl)-4-propan-2-ylcyclohexane-1,2-diamine
CID 107869613
(1S)-7-methyl-4-methylidene-1-(4-propan-2-ylcyclohexyl)octan-1-ol
CID 118287020
N-ethyl-5-methyl-1-(4-propan-2-ylcyclohexyl)hexan-1-amine
CID 83161156
1-cyclopropyloctylcyclopropane
CID 141276542
(1-bromo-5-methylhexyl)cyclopropane
CID 63472651
1-ethyl-3-(5-methylhexan-2-yl)cyclopentane
CID 123613674
2-(3-methylbutoxy)-4-propan-2-ylcyclohexan-1-ol
CID 62708284

Frequently Asked Questions

What is the IUPAC name of 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane?
The IUPAC name of 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane (CID 59268412) is 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane.
What is the SMILES notation for 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane?
The canonical SMILES for 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane is CC(C)CCC(C1CCC(C(C)C)CC1)C1CCC(C(C)C)CC1.
What is the InChIKey of 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane?
The InChIKey is MHNGCDGOOITJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46/c1-17(2)7-16-24(22-12-8-20(9-13-22)18(3)4)23-14-10-21(11-15-23)19(5)6/h17-24H,7-16H2,1-6H3.
What are the key properties of 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane?
1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane has a molecular weight of 334.63 g/mol, XLogP of 7.96, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-methyl-1-(4-propan-2-ylcyclohexyl)pentyl]-4-propan-2-ylcyclohexane is sourced from PubChem (CID 59268412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).