[(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene

C15H20 — CID 10821924

IUPAC[(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene
SMILESCCC[C@]1(C)C[C@@H]1/C=C/c1ccccc1
InChIInChI=1S/C15H20/c1-3-11-15(2)12-14(15)10-9-13-7-5-4-6-8-13/h4-10,14H,3,11-12H2,1-2H3/b10-9+/t14-,15+/m0/s1
InChIKeyAGOBZUJFZNCOQO-LWLVDVGCSA-N
MW200.33 g/mol
LogP4.53
Rot. Bonds4

About [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene

[(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene (PubChem CID 10821924) has the molecular formula C15H20 and a molecular weight of 200.33 g/mol. Its IUPAC name is [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene.

Molecular Properties

Compound Name[(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene
PubChem CID10821924
Molecular FormulaC15H20
Molecular Weight200.33 g/mol
Exact Mass200.16
IUPAC Name[(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene
SMILESCCC[C@]1(C)C[C@@H]1/C=C/c1ccccc1
InChIInChI=1S/C15H20/c1-3-11-15(2)12-14(15)10-9-13-7-5-4-6-8-13/h4-10,14H,3,11-12H2,1-2H3/b10-9+/t14-,15+/m0/s1
InChIKeyAGOBZUJFZNCOQO-LWLVDVGCSA-N
XLogP4.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene with MolForge

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Related Compounds

cis-(1S,3R)-1,2,2-trimethyl-3-(2-phenylethenyl)cyclopentane-1-carboxylic acid
CID 7054115
5,5-dimethyl-2-[(E)-2-phenylethenyl]-1,3-dioxane
CID 6043851
(1S,4S)-1-methyl-4-[(E)-2-phenylethenyl]-3-oxabicyclo[3.1.0]hexane
CID 102095400
3-[(E)-2-phenylethenyl]oxetane
CID 132578776
(2R,3R)-2-[(E)-2-phenylethenyl]-5-oxaspiro[2.5]oct-7-en-4-one
CID 102423593
1,2,2-trimethyl-3-(2-phenylethenyl)cyclopentane-1-carboxylate
CID 4660169
trans-(1S,3S)-1,2,2-trimethyl-3-[(Z)-2-phenylethenyl]cyclopentane-1-carboxylate
CID 7324820
(2S,4aS,7R,8aR)-3-benzyl-4,4,7-trimethyl-2-[(E)-2-phenylethenyl]-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine
CID 11653690
3-[3-methyl-4-[(Z)-2-phenylethenyl]piperidin-1-yl]-1-propylcyclopentane-1-carboxylic acid
CID 142115945
2-chloroethenylbenzene;methanol
CID 159831331
benzene;but-1-enylbenzene
CID 157481332
ethane;[(E)-pent-1-enyl]benzene
CID 143265687

Frequently Asked Questions

What is the IUPAC name of [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene?
The IUPAC name of [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene (CID 10821924) is [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene.
What is the SMILES notation for [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene?
The canonical SMILES for [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene is CCC[C@]1(C)C[C@@H]1/C=C/c1ccccc1.
What is the InChIKey of [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene?
The InChIKey is AGOBZUJFZNCOQO-LWLVDVGCSA-N. The full InChI is InChI=1S/C15H20/c1-3-11-15(2)12-14(15)10-9-13-7-5-4-6-8-13/h4-10,14H,3,11-12H2,1-2H3/b10-9+/t14-,15+/m0/s1.
What are the key properties of [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene?
[(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene has a molecular weight of 200.33 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-[(1R,2R)-2-methyl-2-propylcyclopropyl]ethenyl]benzene is sourced from PubChem (CID 10821924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).