(4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine

C6H13N3 — CID 172964270

IUPAC(4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine
SMILESCC(C)=C(N)/C(C)=N\N
InChIInChI=1S/C6H13N3/c1-4(2)6(7)5(3)9-8/h7-8H2,1-3H3/b9-5-
InChIKeyQLFULEFAWIYLPA-UITAMQMPSA-N
MW127.19 g/mol
LogP0.57
Rot. Bonds1

About (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine

(4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine (PubChem CID 172964270) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine.

Molecular Properties

Compound Name(4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine
PubChem CID172964270
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC Name(4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine
SMILESCC(C)=C(N)/C(C)=N\N
InChIInChI=1S/C6H13N3/c1-4(2)6(7)5(3)9-8/h7-8H2,1-3H3/b9-5-
InChIKeyQLFULEFAWIYLPA-UITAMQMPSA-N
XLogP0.57
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine?
The IUPAC name of (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine (CID 172964270) is (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine.
What is the SMILES notation for (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine?
The canonical SMILES for (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine is CC(C)=C(N)/C(C)=N\N.
What is the InChIKey of (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine?
The InChIKey is QLFULEFAWIYLPA-UITAMQMPSA-N. The full InChI is InChI=1S/C6H13N3/c1-4(2)6(7)5(3)9-8/h7-8H2,1-3H3/b9-5-.
What are the key properties of (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine?
(4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine has a molecular weight of 127.19 g/mol, XLogP of 0.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-hydrazinylidene-2-methylpent-2-en-3-amine is sourced from PubChem (CID 172964270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).