1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane

C15H30 — CID 123850669

IUPAC1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane
SMILESCCCC(C)C(CC)CC(C)C1CC1C
InChIInChI=1S/C15H30/c1-6-8-11(3)14(7-2)9-12(4)15-10-13(15)5/h11-15H,6-10H2,1-5H3
InChIKeyKDGSETNKJRDSRI-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.13
Rot. Bonds7

About 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane

1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane (PubChem CID 123850669) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane
PubChem CID123850669
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane
SMILESCCCC(C)C(CC)CC(C)C1CC1C
InChIInChI=1S/C15H30/c1-6-8-11(3)14(7-2)9-12(4)15-10-13(15)5/h11-15H,6-10H2,1-5H3
InChIKeyKDGSETNKJRDSRI-UHFFFAOYSA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3-ethyl-4-methylheptyl)-2-methylcyclopropane
CID 123890529
1-heptan-2-yl-2-methylcyclopropane
CID 91084036
1,2-dimethyl-3-pentan-2-ylcyclobutane
CID 123945019
1,2-dimethyl-3-(4-methylhexan-2-yl)cyclobutane
CID 123367002
1-methyl-2-(6-methyl-4-propylheptan-3-yl)cyclopropane
CID 123883056
1-(3-ethylpentan-2-yl)-2-methylcyclopropane
CID 91445578
1-(4-ethyl-5-methylhexan-2-yl)-2-methylcyclobutane
CID 91534762
1-methyl-2-(5-methyloctan-3-yl)cyclopropane
CID 123251321
1-methyl-2-(5-methylhexan-2-yl)cyclopropane
CID 91344454
1,2-di(pentan-2-yl)cyclopropane
CID 123763474
3-(2-methylcyclopropyl)butan-1-amine
CID 90983194
1-(4-butan-2-ylnonan-2-yl)-2-methylcycloheptane
CID 123447024

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane?
The IUPAC name of 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane (CID 123850669) is 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane.
What is the SMILES notation for 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane?
The canonical SMILES for 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane is CCCC(C)C(CC)CC(C)C1CC1C.
What is the InChIKey of 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane?
The InChIKey is KDGSETNKJRDSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-6-8-11(3)14(7-2)9-12(4)15-10-13(15)5/h11-15H,6-10H2,1-5H3.
What are the key properties of 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane?
1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane has a molecular weight of 210.40 g/mol, XLogP of 5.13, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane is sourced from PubChem (CID 123850669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).