(7-cyclopentyl-3-methylheptyl)cyclopentane

C18H34 — CID 123466678

IUPAC(7-cyclopentyl-3-methylheptyl)cyclopentane
SMILESCC(CCCCC1CCCC1)CCC1CCCC1
InChIInChI=1S/C18H34/c1-16(14-15-18-12-6-7-13-18)8-2-3-9-17-10-4-5-11-17/h16-18H,2-15H2,1H3
InChIKeyBRALXICDZAMWPM-UHFFFAOYSA-N
MW250.47 g/mol
LogP6.34
Rot. Bonds8

About (7-cyclopentyl-3-methylheptyl)cyclopentane

(7-cyclopentyl-3-methylheptyl)cyclopentane (PubChem CID 123466678) has the molecular formula C18H34 and a molecular weight of 250.47 g/mol. Its IUPAC name is (7-cyclopentyl-3-methylheptyl)cyclopentane.

Molecular Properties

Compound Name(7-cyclopentyl-3-methylheptyl)cyclopentane
PubChem CID123466678
Molecular FormulaC18H34
Molecular Weight250.47 g/mol
Exact Mass250.27
IUPAC Name(7-cyclopentyl-3-methylheptyl)cyclopentane
SMILESCC(CCCCC1CCCC1)CCC1CCCC1
InChIInChI=1S/C18H34/c1-16(14-15-18-12-6-7-13-18)8-2-3-9-17-10-4-5-11-17/h16-18H,2-15H2,1H3
InChIKeyBRALXICDZAMWPM-UHFFFAOYSA-N
XLogP6.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.47
LogP ≤ 56.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6,12-dimethylhexadecylcyclopentane;ethane;methane
CID 145468436
13-methyltetradecylcyclopentane
CID 123698808
(7-ethylsulfanyl-6-methylheptyl)cyclopentane
CID 170850385
4-methylpentylcyclopentane
CID 523530
7-methylnonylcyclopropane
CID 123906260
(3-methyl-4-methylsulfanylbutyl)cyclopentane
CID 139570200
4-cyclopentylbutylcyclohexane
CID 144547696
3,5,6-trimethylheptylcyclohexane
CID 123254149
6-cyclohexyl-3-methylhexanoic acid
CID 165358619
9-cyclopropyl-4-methylnonanoic acid
CID 142774647
7-cyclohexyl-N-ethyl-2-methylheptan-3-amine
CID 114192943
[7-cyclohexyl-4-(2-cyclohexylethyl)heptyl]cyclohexane
CID 71438405

Frequently Asked Questions

What is the IUPAC name of (7-cyclopentyl-3-methylheptyl)cyclopentane?
The IUPAC name of (7-cyclopentyl-3-methylheptyl)cyclopentane (CID 123466678) is (7-cyclopentyl-3-methylheptyl)cyclopentane.
What is the SMILES notation for (7-cyclopentyl-3-methylheptyl)cyclopentane?
The canonical SMILES for (7-cyclopentyl-3-methylheptyl)cyclopentane is CC(CCCCC1CCCC1)CCC1CCCC1.
What is the InChIKey of (7-cyclopentyl-3-methylheptyl)cyclopentane?
The InChIKey is BRALXICDZAMWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34/c1-16(14-15-18-12-6-7-13-18)8-2-3-9-17-10-4-5-11-17/h16-18H,2-15H2,1H3.
What are the key properties of (7-cyclopentyl-3-methylheptyl)cyclopentane?
(7-cyclopentyl-3-methylheptyl)cyclopentane has a molecular weight of 250.47 g/mol, XLogP of 6.34, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7-cyclopentyl-3-methylheptyl)cyclopentane is sourced from PubChem (CID 123466678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).