1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane

C14H26 — CID 123792686

IUPAC1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane
SMILESCC=C(C)CC(C)C1CC1CC(C)C
InChIInChI=1S/C14H26/c1-6-11(4)8-12(5)14-9-13(14)7-10(2)3/h6,10,12-14H,7-9H2,1-5H3
InChIKeyBWVVTAQKJDIOBE-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.66
Rot. Bonds5

About 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane

1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane (PubChem CID 123792686) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane.

Molecular Properties

Compound Name1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane
PubChem CID123792686
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane
SMILESCC=C(C)CC(C)C1CC1CC(C)C
InChIInChI=1S/C14H26/c1-6-11(4)8-12(5)14-9-13(14)7-10(2)3/h6,10,12-14H,7-9H2,1-5H3
InChIKeyBWVVTAQKJDIOBE-UHFFFAOYSA-N
XLogP4.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.66
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-[(1R,2R)-2-(2-methylpropyl)cyclopropyl]propan-1-ol
CID 131228133
1-[2-(2-methylpropyl)cyclopropyl]prop-2-en-1-amine
CID 131228044
1-methyl-2-(2-methylpropyl)cyclopropane
CID 54305717
1-ethyl-2-(7-methylocta-5,6-dien-2-yl)cyclopropane
CID 123441755
cis-(1S,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 173447814
trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 168764244
(E,2R)-2,4-dimethylhex-4-en-1-ol
CID 10103193
trans-(1S,2R)-2-(2-methylpropyl)cyclopropane-1-carboxylic acid
CID 94420067
3,5,9-trimethyldec-2-ene
CID 123396305
4-methyl-2-(2-methylpropyl)cyclopentan-1-ol
CID 67495132
1-(chloromethyl)-2-(2-methylpropyl)cyclopropane
CID 81357896
2,6-dimethylocta-2,6-dien-4-ol
CID 57084943

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane?
The IUPAC name of 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane (CID 123792686) is 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane.
What is the SMILES notation for 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane?
The canonical SMILES for 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane is CC=C(C)CC(C)C1CC1CC(C)C.
What is the InChIKey of 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane?
The InChIKey is BWVVTAQKJDIOBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-6-11(4)8-12(5)14-9-13(14)7-10(2)3/h6,10,12-14H,7-9H2,1-5H3.
What are the key properties of 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane?
1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane has a molecular weight of 194.36 g/mol, XLogP of 4.66, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylhex-4-en-2-yl)-2-(2-methylpropyl)cyclopropane is sourced from PubChem (CID 123792686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).