1-(2,3-dimethylpentyl)-2-propylcyclopropane

C13H26 — CID 123708600

IUPAC1-(2,3-dimethylpentyl)-2-propylcyclopropane
SMILESCCCC1CC1CC(C)C(C)CC
InChIInChI=1S/C13H26/c1-5-7-12-9-13(12)8-11(4)10(3)6-2/h10-13H,5-9H2,1-4H3
InChIKeyMNPHAYDOASJORI-UHFFFAOYSA-N
MW182.35 g/mol
LogP4.49
Rot. Bonds6

About 1-(2,3-dimethylpentyl)-2-propylcyclopropane

1-(2,3-dimethylpentyl)-2-propylcyclopropane (PubChem CID 123708600) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is 1-(2,3-dimethylpentyl)-2-propylcyclopropane.

Molecular Properties

Compound Name1-(2,3-dimethylpentyl)-2-propylcyclopropane
PubChem CID123708600
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Name1-(2,3-dimethylpentyl)-2-propylcyclopropane
SMILESCCCC1CC1CC(C)C(C)CC
InChIInChI=1S/C13H26/c1-5-7-12-9-13(12)8-11(4)10(3)6-2/h10-13H,5-9H2,1-4H3
InChIKeyMNPHAYDOASJORI-UHFFFAOYSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(2-methylbutyl)-2-propylcyclopropane
CID 90912055
1-(3-ethyl-4,5-dimethylheptyl)-2-propylcyclopropane
CID 123532559
1-(2,3-dimethylheptyl)-2-ethylcyclopropane
CID 123157589
1-(2,5-diethyldecyl)-2-propylcyclopropane
CID 90691022
1-(methoxymethyl)-2-propylcyclopropane
CID 123484711
1-(3-ethyl-2-methyltetradecyl)-2-methyl-3-propylcyclobutane
CID 123714162
1-(iodomethyl)-2-propylcyclopropane
CID 88994934
1-(2-methylbutyl)-2-propylcyclobutane
CID 90731668
1-propyl-2-undecylcyclopropane
CID 123636027
1-(4-ethyl-3,6,11-trimethyldodecan-5-yl)-2-propylcyclopropane
CID 123616898
1-(3-methylpent-1-enyl)-2-propylcyclopropane
CID 123732015
1-butyl-2-(6-ethyl-2-methyloctyl)cyclopropane
CID 123426508

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylpentyl)-2-propylcyclopropane?
The IUPAC name of 1-(2,3-dimethylpentyl)-2-propylcyclopropane (CID 123708600) is 1-(2,3-dimethylpentyl)-2-propylcyclopropane.
What is the SMILES notation for 1-(2,3-dimethylpentyl)-2-propylcyclopropane?
The canonical SMILES for 1-(2,3-dimethylpentyl)-2-propylcyclopropane is CCCC1CC1CC(C)C(C)CC.
What is the InChIKey of 1-(2,3-dimethylpentyl)-2-propylcyclopropane?
The InChIKey is MNPHAYDOASJORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26/c1-5-7-12-9-13(12)8-11(4)10(3)6-2/h10-13H,5-9H2,1-4H3.
What are the key properties of 1-(2,3-dimethylpentyl)-2-propylcyclopropane?
1-(2,3-dimethylpentyl)-2-propylcyclopropane has a molecular weight of 182.35 g/mol, XLogP of 4.49, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylpentyl)-2-propylcyclopropane is sourced from PubChem (CID 123708600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).