ethene;1-methyl-2-(3-methylpentyl)cyclopropane

C12H24 — CID 143221228

IUPACethene;1-methyl-2-(3-methylpentyl)cyclopropane
SMILESC=C.CCC(C)CCC1CC1C
InChIInChI=1S/C10H20.C2H4/c1-4-8(2)5-6-10-7-9(10)3;1-2/h8-10H,4-7H2,1-3H3;1-2H2
InChIKeyKROQHZKFTOHHET-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.27
Rot. Bonds4

About ethene;1-methyl-2-(3-methylpentyl)cyclopropane

ethene;1-methyl-2-(3-methylpentyl)cyclopropane (PubChem CID 143221228) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is ethene;1-methyl-2-(3-methylpentyl)cyclopropane.

Molecular Properties

Compound Nameethene;1-methyl-2-(3-methylpentyl)cyclopropane
PubChem CID143221228
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Nameethene;1-methyl-2-(3-methylpentyl)cyclopropane
SMILESC=C.CCC(C)CCC1CC1C
InChIInChI=1S/C10H20.C2H4/c1-4-8(2)5-6-10-7-9(10)3;1-2/h8-10H,4-7H2,1-3H3;1-2H2
InChIKeyKROQHZKFTOHHET-UHFFFAOYSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-methyl-2-(2-methylbutyl)cyclopropane
CID 91076617
1-(3-methylpentyl)-2-(4-methylpentyl)cyclopropane
CID 91283171
1-(3-ethyl-4-methylheptyl)-2-methylcyclopropane
CID 123890529
1-(3,7-dimethylnonyl)-2-methylcyclopentane
CID 123956803
1,2-dimethyl-3-(3-methylpentyl)cyclopropane
CID 91514348
3-methylpentylcyclopropane
CID 56979389
bis(3-methylhexane);1,2,3-trimethylcyclobutane
CID 162022066
trans-(1R,2S)-1-methyl-2-[2-[(1R,2S)-2-methylcyclopropyl]ethyl]cyclopropane
CID 23638911
1,2,3-trimethyl-4-(5-methylheptan-2-yl)cyclohexane
CID 123804533
1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane
CID 123168355
1-ethyl-2-methylcyclopropane;2-methylpropane
CID 155747981
ethane;1-methyl-2-propylcyclopropane
CID 144710386

Frequently Asked Questions

What is the IUPAC name of ethene;1-methyl-2-(3-methylpentyl)cyclopropane?
The IUPAC name of ethene;1-methyl-2-(3-methylpentyl)cyclopropane (CID 143221228) is ethene;1-methyl-2-(3-methylpentyl)cyclopropane.
What is the SMILES notation for ethene;1-methyl-2-(3-methylpentyl)cyclopropane?
The canonical SMILES for ethene;1-methyl-2-(3-methylpentyl)cyclopropane is C=C.CCC(C)CCC1CC1C.
What is the InChIKey of ethene;1-methyl-2-(3-methylpentyl)cyclopropane?
The InChIKey is KROQHZKFTOHHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.C2H4/c1-4-8(2)5-6-10-7-9(10)3;1-2/h8-10H,4-7H2,1-3H3;1-2H2.
What are the key properties of ethene;1-methyl-2-(3-methylpentyl)cyclopropane?
ethene;1-methyl-2-(3-methylpentyl)cyclopropane has a molecular weight of 168.32 g/mol, XLogP of 4.27, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;1-methyl-2-(3-methylpentyl)cyclopropane is sourced from PubChem (CID 143221228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).