(4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane

C11H16O — CID 154722244

IUPAC(4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane
SMILESC=C1CCC/C1=C1\COCC1C
InChIInChI=1S/C11H16O/c1-8-4-3-5-10(8)11-7-12-6-9(11)2/h9H,1,3-7H2,2H3/b11-10-
InChIKeyZAPBCXBIKGGZPL-KHPPLWFESA-N
MW164.25 g/mol
LogP2.69
Rot. Bonds

About (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane

(4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane (PubChem CID 154722244) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane.

Molecular Properties

Compound Name(4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane
PubChem CID154722244
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Name(4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane
SMILESC=C1CCC/C1=C1\COCC1C
InChIInChI=1S/C11H16O/c1-8-4-3-5-10(8)11-7-12-6-9(11)2/h9H,1,3-7H2,2H3/b11-10-
InChIKeyZAPBCXBIKGGZPL-KHPPLWFESA-N
XLogP2.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane?
The IUPAC name of (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane (CID 154722244) is (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane.
What is the SMILES notation for (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane?
The canonical SMILES for (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane is C=C1CCC/C1=C1\COCC1C.
What is the InChIKey of (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane?
The InChIKey is ZAPBCXBIKGGZPL-KHPPLWFESA-N. The full InChI is InChI=1S/C11H16O/c1-8-4-3-5-10(8)11-7-12-6-9(11)2/h9H,1,3-7H2,2H3/b11-10-.
What are the key properties of (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane?
(4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane has a molecular weight of 164.25 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-3-methyl-4-(2-methylidenecyclopentylidene)oxolane is sourced from PubChem (CID 154722244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).