(3E)-3-butylidene-1-methylcyclopentene

C10H16 — CID 11094678

IUPAC(3E)-3-butylidene-1-methylcyclopentene
SMILESCCC/C=C1/C=C(C)CC1
InChIInChI=1S/C10H16/c1-3-4-5-10-7-6-9(2)8-10/h5,8H,3-4,6-7H2,1-2H3/b10-5+
InChIKeyJCSWONZTCXYFJF-BJMVGYQFSA-N
MW136.24 g/mol
LogP3.45
Rot. Bonds2

About (3E)-3-butylidene-1-methylcyclopentene

(3E)-3-butylidene-1-methylcyclopentene (PubChem CID 11094678) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (3E)-3-butylidene-1-methylcyclopentene.

Molecular Properties

Compound Name(3E)-3-butylidene-1-methylcyclopentene
PubChem CID11094678
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(3E)-3-butylidene-1-methylcyclopentene
SMILESCCC/C=C1/C=C(C)CC1
InChIInChI=1S/C10H16/c1-3-4-5-10-7-6-9(2)8-10/h5,8H,3-4,6-7H2,1-2H3/b10-5+
InChIKeyJCSWONZTCXYFJF-BJMVGYQFSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (3E)-3-butylidene-1-methylcyclopentene?
The IUPAC name of (3E)-3-butylidene-1-methylcyclopentene (CID 11094678) is (3E)-3-butylidene-1-methylcyclopentene.
What is the SMILES notation for (3E)-3-butylidene-1-methylcyclopentene?
The canonical SMILES for (3E)-3-butylidene-1-methylcyclopentene is CCC/C=C1/C=C(C)CC1.
What is the InChIKey of (3E)-3-butylidene-1-methylcyclopentene?
The InChIKey is JCSWONZTCXYFJF-BJMVGYQFSA-N. The full InChI is InChI=1S/C10H16/c1-3-4-5-10-7-6-9(2)8-10/h5,8H,3-4,6-7H2,1-2H3/b10-5+.
What are the key properties of (3E)-3-butylidene-1-methylcyclopentene?
(3E)-3-butylidene-1-methylcyclopentene has a molecular weight of 136.24 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-butylidene-1-methylcyclopentene is sourced from PubChem (CID 11094678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).