1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane

C18H36 — CID 123947134

IUPAC1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane
SMILESCC(C)CC(CC1C(C)(C)CCC1(C)C)C(C)C
InChIInChI=1S/C18H36/c1-13(2)11-15(14(3)4)12-16-17(5,6)9-10-18(16,7)8/h13-16H,9-12H2,1-8H3
InChIKeyILZCNCBZSKUBMV-UHFFFAOYSA-N
MW252.49 g/mol
LogP6.16
Rot. Bonds5

About 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane

1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane (PubChem CID 123947134) has the molecular formula C18H36 and a molecular weight of 252.49 g/mol. Its IUPAC name is 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane.

Molecular Properties

Compound Name1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane
PubChem CID123947134
Molecular FormulaC18H36
Molecular Weight252.49 g/mol
Exact Mass252.28
IUPAC Name1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane
SMILESCC(C)CC(CC1C(C)(C)CCC1(C)C)C(C)C
InChIInChI=1S/C18H36/c1-13(2)11-15(14(3)4)12-16-17(5,6)9-10-18(16,7)8/h13-16H,9-12H2,1-8H3
InChIKeyILZCNCBZSKUBMV-UHFFFAOYSA-N
XLogP6.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.49
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1-dimethyl-2-(2-methylpropyl)cyclobutane
CID 123767451
2-methyl-4-propan-2-ylheptane
CID 21201044
(3S)-3-(methoxymethyl)-2,5-dimethylhexane
CID 121338192
(3S)-2,5-dimethyl-3-[[3-methyl-2-[[(2R)-4-methyl-2-propan-2-ylpentoxy]methyl]butoxy]methyl]hexane
CID 87692911
bis(3-ethyl-2,5-dimethylhexane);2,3,5-trimethylhexane
CID 158124922
2,13-dimethyl-4-propan-2-yltetradecane
CID 140816601
1-cyclopropyl-4-methylpentan-2-amine
CID 62753020
3,3-dimethyl-2-(2-methylpropyl)pyrrolidine
CID 62753360
2,4-dimethylpentane
CID 157050020
2,5,5,8a-tetramethyl-1-(2-methylpropyl)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol
CID 162276385
1,2-dimethyl-1-(4-methylpentan-2-yl)cyclopropane
CID 123348354
2-(2,4-dimethylpentyl)oxirane
CID 14618591

Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane?
The IUPAC name of 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane (CID 123947134) is 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane.
What is the SMILES notation for 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane?
The canonical SMILES for 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane is CC(C)CC(CC1C(C)(C)CCC1(C)C)C(C)C.
What is the InChIKey of 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane?
The InChIKey is ILZCNCBZSKUBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36/c1-13(2)11-15(14(3)4)12-16-17(5,6)9-10-18(16,7)8/h13-16H,9-12H2,1-8H3.
What are the key properties of 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane?
1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane has a molecular weight of 252.49 g/mol, XLogP of 6.16, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetramethyl-2-(4-methyl-2-propan-2-ylpentyl)cyclopentane is sourced from PubChem (CID 123947134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).