(Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine

C8H10N2 — CID 89298171

IUPAC(Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine
SMILESC=C/N=C1\C=CC\C1=C\N
InChIInChI=1S/C8H10N2/c1-2-10-8-5-3-4-7(8)6-9/h2-3,5-6H,1,4,9H2/b7-6-,10-8+
InChIKeyQHCYYQQGJVCWHG-VAAURPRASA-N
MW134.18 g/mol
LogP1.37
Rot. Bonds1

About (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine

(Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine (PubChem CID 89298171) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine.

Molecular Properties

Compound Name(Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine
PubChem CID89298171
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name(Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine
SMILESC=C/N=C1\C=CC\C1=C\N
InChIInChI=1S/C8H10N2/c1-2-10-8-5-3-4-7(8)6-9/h2-3,5-6H,1,4,9H2/b7-6-,10-8+
InChIKeyQHCYYQQGJVCWHG-VAAURPRASA-N
XLogP1.37
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine?
The IUPAC name of (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine (CID 89298171) is (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine.
What is the SMILES notation for (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine?
The canonical SMILES for (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine is C=C/N=C1\C=CC\C1=C\N.
What is the InChIKey of (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine?
The InChIKey is QHCYYQQGJVCWHG-VAAURPRASA-N. The full InChI is InChI=1S/C8H10N2/c1-2-10-8-5-3-4-7(8)6-9/h2-3,5-6H,1,4,9H2/b7-6-,10-8+.
What are the key properties of (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine?
(Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine has a molecular weight of 134.18 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-(2-ethenyliminocyclopent-3-en-1-ylidene)methanamine is sourced from PubChem (CID 89298171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).