1-hexyl-1-(methoxymethyl)cyclopentane

C13H26O — CID 143807105

IUPAC1-hexyl-1-(methoxymethyl)cyclopentane
SMILESCCCCCCC1(COC)CCCC1
InChIInChI=1S/C13H26O/c1-3-4-5-6-9-13(12-14-2)10-7-8-11-13/h3-12H2,1-2H3
InChIKeyUYPJOEKVDQHKGR-UHFFFAOYSA-N
MW198.35 g/mol
LogP4.16
Rot. Bonds7

About 1-hexyl-1-(methoxymethyl)cyclopentane

1-hexyl-1-(methoxymethyl)cyclopentane (PubChem CID 143807105) has the molecular formula C13H26O and a molecular weight of 198.35 g/mol. Its IUPAC name is 1-hexyl-1-(methoxymethyl)cyclopentane.

Molecular Properties

Compound Name1-hexyl-1-(methoxymethyl)cyclopentane
PubChem CID143807105
Molecular FormulaC13H26O
Molecular Weight198.35 g/mol
Exact Mass198.20
IUPAC Name1-hexyl-1-(methoxymethyl)cyclopentane
SMILESCCCCCCC1(COC)CCCC1
InChIInChI=1S/C13H26O/c1-3-4-5-6-9-13(12-14-2)10-7-8-11-13/h3-12H2,1-2H3
InChIKeyUYPJOEKVDQHKGR-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1-dioctylcyclopentane
CID 54295272
1,1-dihexadecylcyclopentane
CID 141255150
1,1-di(nonyl)cyclopentane
CID 154318487
ethane;1-(methoxymethyl)-1-propylcyclopentane
CID 143806992
1,1-dipentylcyclononane
CID 169026027
ethane;1-(2-methoxyethyl)-1-(methoxymethyl)cyclopentane
CID 143807089
(1-hexylcyclohexyl)methanol
CID 66024993
(1-pentylcyclopentyl)methanamine
CID 62725889
methyl 8-(1-heptylcyclohexyl)octanoate
CID 118260042
(1-heptylcyclooctyl)methyl prop-2-enoate
CID 141276074
1-(chloromethyl)-1-pentylcyclohexane
CID 66036692
1-butyl-1-(1-butylcyclohexyl)cyclohexane
CID 173069670

Frequently Asked Questions

What is the IUPAC name of 1-hexyl-1-(methoxymethyl)cyclopentane?
The IUPAC name of 1-hexyl-1-(methoxymethyl)cyclopentane (CID 143807105) is 1-hexyl-1-(methoxymethyl)cyclopentane.
What is the SMILES notation for 1-hexyl-1-(methoxymethyl)cyclopentane?
The canonical SMILES for 1-hexyl-1-(methoxymethyl)cyclopentane is CCCCCCC1(COC)CCCC1.
What is the InChIKey of 1-hexyl-1-(methoxymethyl)cyclopentane?
The InChIKey is UYPJOEKVDQHKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O/c1-3-4-5-6-9-13(12-14-2)10-7-8-11-13/h3-12H2,1-2H3.
What are the key properties of 1-hexyl-1-(methoxymethyl)cyclopentane?
1-hexyl-1-(methoxymethyl)cyclopentane has a molecular weight of 198.35 g/mol, XLogP of 4.16, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexyl-1-(methoxymethyl)cyclopentane is sourced from PubChem (CID 143807105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).