(Z)-4-imino-N'-methanimidoylpent-2-enimidamide

C6H10N4 — CID 137410872

IUPAC(Z)-4-imino-N'-methanimidoylpent-2-enimidamide
SMILES[H]/N=C/N=C(N)/C=C\C(C)=N\[H]
InChIInChI=1S/C6H10N4/c1-5(8)2-3-6(9)10-4-7/h2-4,8H,1H3,(H3,7,9,10)/b3-2-,8-5+
InChIKeyKCQMCTHJHQRTFT-JGWPUVKASA-N
MW138.17 g/mol
LogP0.55
Rot. Bonds3

About (Z)-4-imino-N'-methanimidoylpent-2-enimidamide

(Z)-4-imino-N'-methanimidoylpent-2-enimidamide (PubChem CID 137410872) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is (Z)-4-imino-N'-methanimidoylpent-2-enimidamide.

Molecular Properties

Compound Name(Z)-4-imino-N'-methanimidoylpent-2-enimidamide
PubChem CID137410872
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name(Z)-4-imino-N'-methanimidoylpent-2-enimidamide
SMILES[H]/N=C/N=C(N)/C=C\C(C)=N\[H]
InChIInChI=1S/C6H10N4/c1-5(8)2-3-6(9)10-4-7/h2-4,8H,1H3,(H3,7,9,10)/b3-2-,8-5+
InChIKeyKCQMCTHJHQRTFT-JGWPUVKASA-N
XLogP0.55
TPSA86.08 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze (Z)-4-imino-N'-methanimidoylpent-2-enimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-4-imino-N'-methanimidoylpent-2-enimidamide?
The IUPAC name of (Z)-4-imino-N'-methanimidoylpent-2-enimidamide (CID 137410872) is (Z)-4-imino-N'-methanimidoylpent-2-enimidamide.
What is the SMILES notation for (Z)-4-imino-N'-methanimidoylpent-2-enimidamide?
The canonical SMILES for (Z)-4-imino-N'-methanimidoylpent-2-enimidamide is [H]/N=C/N=C(N)/C=C\C(C)=N\[H].
What is the InChIKey of (Z)-4-imino-N'-methanimidoylpent-2-enimidamide?
The InChIKey is KCQMCTHJHQRTFT-JGWPUVKASA-N. The full InChI is InChI=1S/C6H10N4/c1-5(8)2-3-6(9)10-4-7/h2-4,8H,1H3,(H3,7,9,10)/b3-2-,8-5+.
What are the key properties of (Z)-4-imino-N'-methanimidoylpent-2-enimidamide?
(Z)-4-imino-N'-methanimidoylpent-2-enimidamide has a molecular weight of 138.17 g/mol, XLogP of 0.55, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-imino-N'-methanimidoylpent-2-enimidamide is sourced from PubChem (CID 137410872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).