1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane

C17H34 — CID 123532559

IUPAC1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane
SMILESCCCC1CC1CCC(CC)C(C)C(C)CC
InChIInChI=1S/C17H34/c1-6-9-16-12-17(16)11-10-15(8-3)14(5)13(4)7-2/h13-17H,6-12H2,1-5H3
InChIKeyPRJBDSFNKPSKIM-UHFFFAOYSA-N
MW238.46 g/mol
LogP5.91
Rot. Bonds9

About 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane

1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane (PubChem CID 123532559) has the molecular formula C17H34 and a molecular weight of 238.46 g/mol. Its IUPAC name is 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane.

Molecular Properties

Compound Name1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane
PubChem CID123532559
Molecular FormulaC17H34
Molecular Weight238.46 g/mol
Exact Mass238.27
IUPAC Name1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane
SMILESCCCC1CC1CCC(CC)C(C)C(C)CC
InChIInChI=1S/C17H34/c1-6-9-16-12-17(16)11-10-15(8-3)14(5)13(4)7-2/h13-17H,6-12H2,1-5H3
InChIKeyPRJBDSFNKPSKIM-UHFFFAOYSA-N
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.46
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(3-ethyl-4,5-dimethylheptyl)cyclopropane
CID 123809704
1-(2,3-dimethylpentyl)-2-propylcyclopropane
CID 123708600
1-(2-methylbutyl)-2-propylcyclopropane
CID 90912055
1-(3,4-dimethylpentyl)-2-ethylcyclopropane
CID 123908789
1-(3-ethyl-4-methylheptyl)-2-methylcyclopropane
CID 123890529
1-(3,4-dimethylheptyl)-2-ethylcyclopropane
CID 123989323
1-(3-ethyl-2-methyltetradecyl)-2-methyl-3-propylcyclobutane
CID 123714162
1-(methoxymethyl)-2-propylcyclopropane
CID 123484711
1-(iodomethyl)-2-propylcyclopropane
CID 88994934
1-butyl-2-[5-(2-butylcyclopropyl)-3-methoxypentyl]cyclopropane
CID 170756743
2,3,6,7-tetramethyl-5-propylnonane
CID 91235316
5-ethyl-2,6,7-trimethyldecane
CID 123648141

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane?
The IUPAC name of 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane (CID 123532559) is 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane.
What is the SMILES notation for 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane?
The canonical SMILES for 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane is CCCC1CC1CCC(CC)C(C)C(C)CC.
What is the InChIKey of 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane?
The InChIKey is PRJBDSFNKPSKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34/c1-6-9-16-12-17(16)11-10-15(8-3)14(5)13(4)7-2/h13-17H,6-12H2,1-5H3.
What are the key properties of 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane?
1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane has a molecular weight of 238.46 g/mol, XLogP of 5.91, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane is sourced from PubChem (CID 123532559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).