(2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane

C12H22 — CID 13138928

IUPAC(2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane
SMILESC/C(=C1\CC1C(C)(C)C)C(C)C
InChIInChI=1S/C12H22/c1-8(2)9(3)10-7-11(10)12(4,5)6/h8,11H,7H2,1-6H3/b10-9-
InChIKeyWCVWSAMHYANCDG-KTKRTIGZSA-N
MW166.31 g/mol
LogP4.02
Rot. Bonds1

About (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane

(2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane (PubChem CID 13138928) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane.

Molecular Properties

Compound Name(2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane
PubChem CID13138928
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name(2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane
SMILESC/C(=C1\CC1C(C)(C)C)C(C)C
InChIInChI=1S/C12H22/c1-8(2)9(3)10-7-11(10)12(4,5)6/h8,11H,7H2,1-6H3/b10-9-
InChIKeyWCVWSAMHYANCDG-KTKRTIGZSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.31
LogP ≤ 54.02
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

1,1-Dimethyl-2-(2-methyl-1-propenyl)cyclopropane
CID 520632
2-Hexene, 2,3,5,5-tetramethyl-
CID 141765
Cyclopropane, tetramethyl(2-methyl-1-propenylidene)-
CID 139426
1,1,2-Trimethyl-3-(2-methylprop-1-en-1-ylidene)cyclopropane
CID 139833
1,1,2,2-Tetramethyl-3-(3-methylbuta-1,2-dienylidene)cyclopropane
CID 12615685
1,1,2,2-Tetramethyl-3-(2,2,3,3-tetramethylcyclopropylidene)cyclopropane
CID 13396196
trans-(2R,3R)-1,1,2-trimethyl-3-(2-methylprop-1-enyl)cyclopropane
CID 134833414
Propane, 2-(2-isopropylidene-3-methylcyclopropyl)-, cis-
CID 32478
Propane, 2-(tetramethylcyclopropylidene)-
CID 557285
Cyclopropane, 1-methyl-2-(1-methylethyl)-3-(1-methylethylidene)-, cis-
CID 91694343
trans-2,3,4,6,6-Pentamethyl-hept-3-ene
CID 60046689
1,1,2-Trimethyl-3-(2-methyl-1-propenyl)cyclopropane
CID 579296

Frequently Asked Questions

What is the IUPAC name of (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane?
The IUPAC name of (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane (CID 13138928) is (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane.
What is the SMILES notation for (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane?
The canonical SMILES for (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane is C/C(=C1\CC1C(C)(C)C)C(C)C.
What is the InChIKey of (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane?
The InChIKey is WCVWSAMHYANCDG-KTKRTIGZSA-N. The full InChI is InChI=1S/C12H22/c1-8(2)9(3)10-7-11(10)12(4,5)6/h8,11H,7H2,1-6H3/b10-9-.
What are the key properties of (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane?
(2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane has a molecular weight of 166.31 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-1-tert-butyl-2-(3-methylbutan-2-ylidene)cyclopropane is sourced from PubChem (CID 13138928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).