1-(3,4-dimethylheptyl)-2-ethylcyclopropane

C14H28 — CID 123989323

IUPAC1-(3,4-dimethylheptyl)-2-ethylcyclopropane
SMILESCCCC(C)C(C)CCC1CC1CC
InChIInChI=1S/C14H28/c1-5-7-11(3)12(4)8-9-14-10-13(14)6-2/h11-14H,5-10H2,1-4H3
InChIKeyFDQQBVNEKHXGTK-UHFFFAOYSA-N
MW196.38 g/mol
LogP4.89
Rot. Bonds7

About 1-(3,4-dimethylheptyl)-2-ethylcyclopropane

1-(3,4-dimethylheptyl)-2-ethylcyclopropane (PubChem CID 123989323) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is 1-(3,4-dimethylheptyl)-2-ethylcyclopropane.

Molecular Properties

Compound Name1-(3,4-dimethylheptyl)-2-ethylcyclopropane
PubChem CID123989323
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name1-(3,4-dimethylheptyl)-2-ethylcyclopropane
SMILESCCCC(C)C(C)CCC1CC1CC
InChIInChI=1S/C14H28/c1-5-7-11(3)12(4)8-9-14-10-13(14)6-2/h11-14H,5-10H2,1-4H3
InChIKeyFDQQBVNEKHXGTK-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.38
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3,4-dimethylpentyl)-2-ethylcyclopropane
CID 123908789
1-(3-cyclopropylbutyl)-2-ethylcyclopropane
CID 123702350
1-(2,3-dimethylheptyl)-2-ethylcyclopropane
CID 123157589
1-ethyl-2-(5-methylhexyl)cyclopropane
CID 123182568
cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane
CID 143682309
cis-(1R,2S)-1-butyl-2-ethylcyclopropane
CID 6427612
1-ethyl-2-[(2-pentan-2-ylcyclopropyl)methyl]cyclopropane
CID 123666565
1-butyl-2-ethylcyclopropane;2-methylbutane;propane
CID 143683372
1-(3-ethyl-4-methylheptyl)-2-methylcyclopropane
CID 123890529
1-ethyl-2-[2-(2-methylcyclopropyl)ethyl]cyclopropane
CID 123992340
1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane
CID 123532559
cis-(1S,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 173447814

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylheptyl)-2-ethylcyclopropane?
The IUPAC name of 1-(3,4-dimethylheptyl)-2-ethylcyclopropane (CID 123989323) is 1-(3,4-dimethylheptyl)-2-ethylcyclopropane.
What is the SMILES notation for 1-(3,4-dimethylheptyl)-2-ethylcyclopropane?
The canonical SMILES for 1-(3,4-dimethylheptyl)-2-ethylcyclopropane is CCCC(C)C(C)CCC1CC1CC.
What is the InChIKey of 1-(3,4-dimethylheptyl)-2-ethylcyclopropane?
The InChIKey is FDQQBVNEKHXGTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-5-7-11(3)12(4)8-9-14-10-13(14)6-2/h11-14H,5-10H2,1-4H3.
What are the key properties of 1-(3,4-dimethylheptyl)-2-ethylcyclopropane?
1-(3,4-dimethylheptyl)-2-ethylcyclopropane has a molecular weight of 196.38 g/mol, XLogP of 4.89, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylheptyl)-2-ethylcyclopropane is sourced from PubChem (CID 123989323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).