(Z)-4-ethenyliminopent-2-en-2-amine

C7H12N2 — CID 89224049

IUPAC(Z)-4-ethenyliminopent-2-en-2-amine
SMILESC=C/N=C(C)/C=C(/C)N
InChIInChI=1S/C7H12N2/c1-4-9-7(3)5-6(2)8/h4-5H,1,8H2,2-3H3/b6-5-,9-7+
InChIKeyMIWVZFWMIKBYIH-BZWSEGBZSA-N
MW124.19 g/mol
LogP1.45
Rot. Bonds2

About (Z)-4-ethenyliminopent-2-en-2-amine

(Z)-4-ethenyliminopent-2-en-2-amine (PubChem CID 89224049) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is (Z)-4-ethenyliminopent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-4-ethenyliminopent-2-en-2-amine
PubChem CID89224049
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name(Z)-4-ethenyliminopent-2-en-2-amine
SMILESC=C/N=C(C)/C=C(/C)N
InChIInChI=1S/C7H12N2/c1-4-9-7(3)5-6(2)8/h4-5H,1,8H2,2-3H3/b6-5-,9-7+
InChIKeyMIWVZFWMIKBYIH-BZWSEGBZSA-N
XLogP1.45
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.45
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)-4-ethenyliminopent-2-en-2-amine?
The IUPAC name of (Z)-4-ethenyliminopent-2-en-2-amine (CID 89224049) is (Z)-4-ethenyliminopent-2-en-2-amine.
What is the SMILES notation for (Z)-4-ethenyliminopent-2-en-2-amine?
The canonical SMILES for (Z)-4-ethenyliminopent-2-en-2-amine is C=C/N=C(C)/C=C(/C)N.
What is the InChIKey of (Z)-4-ethenyliminopent-2-en-2-amine?
The InChIKey is MIWVZFWMIKBYIH-BZWSEGBZSA-N. The full InChI is InChI=1S/C7H12N2/c1-4-9-7(3)5-6(2)8/h4-5H,1,8H2,2-3H3/b6-5-,9-7+.
What are the key properties of (Z)-4-ethenyliminopent-2-en-2-amine?
(Z)-4-ethenyliminopent-2-en-2-amine has a molecular weight of 124.19 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-ethenyliminopent-2-en-2-amine is sourced from PubChem (CID 89224049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).