1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane

C15H30 — CID 91283171

IUPAC1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane
SMILESCCC(C)CCC1CC1CCCC(C)C
InChIInChI=1S/C15H30/c1-5-13(4)9-10-15-11-14(15)8-6-7-12(2)3/h12-15H,5-11H2,1-4H3
InChIKeyQLMGXJDWRAJOOZ-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.28
Rot. Bonds8

About 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane

1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane (PubChem CID 91283171) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane.

Molecular Properties

Compound Name1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane
PubChem CID91283171
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane
SMILESCCC(C)CCC1CC1CCCC(C)C
InChIInChI=1S/C15H30/c1-5-13(4)9-10-15-11-14(15)8-6-7-12(2)3/h12-15H,5-11H2,1-4H3
InChIKeyQLMGXJDWRAJOOZ-UHFFFAOYSA-N
XLogP5.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
The IUPAC name of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane (CID 91283171) is 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane.
What is the SMILES notation for 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
The canonical SMILES for 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane is CCC(C)CCC1CC1CCCC(C)C.
What is the InChIKey of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
The InChIKey is QLMGXJDWRAJOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-5-13(4)9-10-15-11-14(15)8-6-7-12(2)3/h12-15H,5-11H2,1-4H3.
What are the key properties of 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane?
1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane has a molecular weight of 210.40 g/mol, XLogP of 5.28, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane is sourced from PubChem (CID 91283171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).