1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane

C9H16 — CID 520632

IUPAC1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane
SMILESCC(C)=CC1CC1(C)C
InChIInChI=1S/C9H16/c1-7(2)5-8-6-9(8,3)4/h5,8H,6H2,1-4H3
InChIKeyJLEYIXWABQURRS-UHFFFAOYSA-N
MW124.23 g/mol
LogP3.00
Rot. Bonds1

About 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane

1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane (PubChem CID 520632) has the molecular formula C9H16 and a molecular weight of 124.23 g/mol. Its IUPAC name is 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane.

Molecular Properties

Compound Name1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane
PubChem CID520632
Molecular FormulaC9H16
Molecular Weight124.23 g/mol
Exact Mass124.13
IUPAC Name1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane
SMILESCC(C)=CC1CC1(C)C
InChIInChI=1S/C9H16/c1-7(2)5-8-6-9(8,3)4/h5,8H,6H2,1-4H3
InChIKeyJLEYIXWABQURRS-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 53.00
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-methylprop-1-enyl)cyclopropane;formyl chloride
CID 159817831
2-(2-fluoroprop-1-enyl)-1,1-dimethylcyclopropane
CID 54075210
tert-butylcarbamothioic S-acid;1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane
CID 88764552
(2S)-2-(2,2-dibromoethenyl)-1,1-dimethylcyclopropane
CID 88596820
2-(2-methylprop-1-enyl)cyclopropane-1,1-dicarboxylic acid
CID 20558390
(2S)-2-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-1,1-dimethylcyclopropane
CID 141315541
2-[(Z)-2,3-dichloro-3,3-difluoroprop-1-enyl]-1,1-dimethylcyclopropane
CID 173412089
tert-butyl 1-methyl-2-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
CID 141102764
(2E)-2-[(2,2-dimethylcyclopropyl)methylidene]-3-methylbutanenitrile
CID 89273892
(E,2Z)-2-[[(1S)-2,2-dimethylcyclopropyl]methylidene]pent-3-enenitrile
CID 88897301
(NE)-N-[(2,2-dimethylcyclopropyl)methylidene]hydroxylamine
CID 11159312
[(Z)-1-[(1S)-2,2-dimethylcyclopropyl]prop-1-en-2-yl] N,N-di(propan-2-yl)carbamate
CID 101381446

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane?
The IUPAC name of 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane (CID 520632) is 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane.
What is the SMILES notation for 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane?
The canonical SMILES for 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane is CC(C)=CC1CC1(C)C.
What is the InChIKey of 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane?
The InChIKey is JLEYIXWABQURRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16/c1-7(2)5-8-6-9(8,3)4/h5,8H,6H2,1-4H3.
What are the key properties of 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane?
1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane has a molecular weight of 124.23 g/mol, XLogP of 3.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane is sourced from PubChem (CID 520632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).