1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane

C15H28 — CID 91156237

IUPAC1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane
SMILESCCCCC(C)=C(C)CC1CC1CCC
InChIInChI=1S/C15H28/c1-5-7-9-12(3)13(4)10-15-11-14(15)8-6-2/h14-15H,5-11H2,1-4H3
InChIKeyHWFZXXYBTLUXCZ-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.34
Rot. Bonds7

About 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane

1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane (PubChem CID 91156237) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane.

Molecular Properties

Compound Name1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane
PubChem CID91156237
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane
SMILESCCCCC(C)=C(C)CC1CC1CCC
InChIInChI=1S/C15H28/c1-5-7-9-12(3)13(4)10-15-11-14(15)8-6-2/h14-15H,5-11H2,1-4H3
InChIKeyHWFZXXYBTLUXCZ-UHFFFAOYSA-N
XLogP5.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.34
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

7-(1-Methylethylidene)bicyclo(4.1.0)heptane
CID 40707
cis-(1S,2R)-1-(2-methylprop-1-enyl)-2-prop-1-en-2-ylcyclopropane
CID 13745740
2,3,4,5,6,7,8,9,10,11,12,13-Dodecahydro-2-methyl-1H-cyclopentacyclododecene
CID 14609946
1,2-Dimethyl-4-(prop-1-en-2-yl)cyclohex-1-ene
CID 524202
1,3,3-Trimethyl-2-(2-methyl-cyclopropyl)-cyclohexene
CID 595941
cis-(1R,2S)-1-(2-methylprop-1-enyl)-2-prop-1-en-2-ylcyclopropane
CID 11126315
1,2,3-Trimethylcyclohex-1-ene
CID 12537123
2,3,4-Trimethylhept-2-ene
CID 22996828
(6S)-2,6-Dimethyl-2-decene
CID 10953936
2,6-Dimethyl-2-decene
CID 11105766
(6R)-2,6-Dimethyl-2-decene
CID 15291114
Cyclopentene, 1,3-dimethyl-2-(1-methylethyl)-
CID 579282

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane?
The IUPAC name of 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane (CID 91156237) is 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane.
What is the SMILES notation for 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane?
The canonical SMILES for 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane is CCCCC(C)=C(C)CC1CC1CCC.
What is the InChIKey of 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane?
The InChIKey is HWFZXXYBTLUXCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-5-7-9-12(3)13(4)10-15-11-14(15)8-6-2/h14-15H,5-11H2,1-4H3.
What are the key properties of 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane?
1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane has a molecular weight of 208.39 g/mol, XLogP of 5.34, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylhept-2-enyl)-2-propylcyclopropane is sourced from PubChem (CID 91156237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).