(2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane

C15H23Br — CID 15273335

IUPAC(2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane
SMILESCC(C)=C/C(C)=C1\CCCC1C(Br)=C(C)C
InChIInChI=1S/C15H23Br/c1-10(2)9-12(5)13-7-6-8-14(13)15(16)11(3)4/h9,14H,6-8H2,1-5H3/b13-12+
InChIKeyHXXLRQGYFJKNAW-OUKQBFOZSA-N
MW283.25 g/mol
LogP5.76
Rot. Bonds2

About (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane

(2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane (PubChem CID 15273335) has the molecular formula C15H23Br and a molecular weight of 283.25 g/mol. Its IUPAC name is (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane.

Molecular Properties

Compound Name(2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane
PubChem CID15273335
Molecular FormulaC15H23Br
Molecular Weight283.25 g/mol
Exact Mass282.10
IUPAC Name(2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane
SMILESCC(C)=C/C(C)=C1\CCCC1C(Br)=C(C)C
InChIInChI=1S/C15H23Br/c1-10(2)9-12(5)13-7-6-8-14(13)15(16)11(3)4/h9,14H,6-8H2,1-5H3/b13-12+
InChIKeyHXXLRQGYFJKNAW-OUKQBFOZSA-N
XLogP5.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.25
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane?
The IUPAC name of (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane (CID 15273335) is (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane.
What is the SMILES notation for (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane?
The canonical SMILES for (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane is CC(C)=C/C(C)=C1\CCCC1C(Br)=C(C)C.
What is the InChIKey of (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane?
The InChIKey is HXXLRQGYFJKNAW-OUKQBFOZSA-N. The full InChI is InChI=1S/C15H23Br/c1-10(2)9-12(5)13-7-6-8-14(13)15(16)11(3)4/h9,14H,6-8H2,1-5H3/b13-12+.
What are the key properties of (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane?
(2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane has a molecular weight of 283.25 g/mol, XLogP of 5.76, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-1-(1-bromo-2-methylprop-1-enyl)-2-(4-methylpent-3-en-2-ylidene)cyclopentane is sourced from PubChem (CID 15273335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).