(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine

C7H13N3 — CID 173482086

IUPAC(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine
SMILESC=C(N)N=C(C)/C=C(/C)N
InChIInChI=1S/C7H13N3/c1-5(8)4-6(2)10-7(3)9/h4H,3,8-9H2,1-2H3/b5-4-,10-6?
InChIKeyHSBPZZVIDVYZNE-FDCSGBFTSA-N
MW139.20 g/mol
LogP0.74
Rot. Bonds2

About (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine

(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine (PubChem CID 173482086) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine
PubChem CID173482086
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine
SMILESC=C(N)N=C(C)/C=C(/C)N
InChIInChI=1S/C7H13N3/c1-5(8)4-6(2)10-7(3)9/h4H,3,8-9H2,1-2H3/b5-4-,10-6?
InChIKeyHSBPZZVIDVYZNE-FDCSGBFTSA-N
XLogP0.74
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(1-aminoethenylimino)pent-2-en-2-amine?
The IUPAC name of (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine (CID 173482086) is (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine.
What is the SMILES notation for (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine?
The canonical SMILES for (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine is C=C(N)N=C(C)/C=C(/C)N.
What is the InChIKey of (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine?
The InChIKey is HSBPZZVIDVYZNE-FDCSGBFTSA-N. The full InChI is InChI=1S/C7H13N3/c1-5(8)4-6(2)10-7(3)9/h4H,3,8-9H2,1-2H3/b5-4-,10-6?.
What are the key properties of (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine?
(Z)-4-(1-aminoethenylimino)pent-2-en-2-amine has a molecular weight of 139.20 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(1-aminoethenylimino)pent-2-en-2-amine is sourced from PubChem (CID 173482086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).