1-(6-cyclopropylhexyl)-2-ethylcyclopropane

C14H26 — CID 123193408

IUPAC1-(6-cyclopropylhexyl)-2-ethylcyclopropane
SMILESCCC1CC1CCCCCCC1CC1
InChIInChI=1S/C14H26/c1-2-13-11-14(13)8-6-4-3-5-7-12-9-10-12/h12-14H,2-11H2,1H3
InChIKeyWAGSRGRTZJIHKV-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.78
Rot. Bonds8

About 1-(6-cyclopropylhexyl)-2-ethylcyclopropane

1-(6-cyclopropylhexyl)-2-ethylcyclopropane (PubChem CID 123193408) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 1-(6-cyclopropylhexyl)-2-ethylcyclopropane.

Molecular Properties

Compound Name1-(6-cyclopropylhexyl)-2-ethylcyclopropane
PubChem CID123193408
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name1-(6-cyclopropylhexyl)-2-ethylcyclopropane
SMILESCCC1CC1CCCCCCC1CC1
InChIInChI=1S/C14H26/c1-2-13-11-14(13)8-6-4-3-5-7-12-9-10-12/h12-14H,2-11H2,1H3
InChIKeyWAGSRGRTZJIHKV-UHFFFAOYSA-N
XLogP4.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.78
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

cis-(1R,2S)-1-butyl-2-ethylcyclopropane
CID 6427612
1,4-dihexylcyclohexane
CID 22947938
1-hexyl-2-undecylcyclopropane
CID 58049498
1-butyl-2-[8-(2-butylcyclopropyl)octyl]cyclopropane
CID 23590146
1,2-dioctylcyclopropane
CID 21337627
octadecane;pentadecylcyclopropane
CID 173301851
tetradecane;undecylcyclopropane
CID 173215670
1-dodecyl-4-pentadecylcyclohexane
CID 123560684
1-ethyl-2-(5-methylhexyl)cyclopropane
CID 123182568
azane;hexylcyclopropane
CID 135322230
1-ethyl-4-[2-(4-heptylcyclohexyl)ethyl]cyclohexane
CID 14227509
hexane;pentylcyclopropane
CID 159592467

Frequently Asked Questions

What is the IUPAC name of 1-(6-cyclopropylhexyl)-2-ethylcyclopropane?
The IUPAC name of 1-(6-cyclopropylhexyl)-2-ethylcyclopropane (CID 123193408) is 1-(6-cyclopropylhexyl)-2-ethylcyclopropane.
What is the SMILES notation for 1-(6-cyclopropylhexyl)-2-ethylcyclopropane?
The canonical SMILES for 1-(6-cyclopropylhexyl)-2-ethylcyclopropane is CCC1CC1CCCCCCC1CC1.
What is the InChIKey of 1-(6-cyclopropylhexyl)-2-ethylcyclopropane?
The InChIKey is WAGSRGRTZJIHKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-2-13-11-14(13)8-6-4-3-5-7-12-9-10-12/h12-14H,2-11H2,1H3.
What are the key properties of 1-(6-cyclopropylhexyl)-2-ethylcyclopropane?
1-(6-cyclopropylhexyl)-2-ethylcyclopropane has a molecular weight of 194.36 g/mol, XLogP of 4.78, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-cyclopropylhexyl)-2-ethylcyclopropane is sourced from PubChem (CID 123193408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).