(Z)-4-amino-2-ethylimino-N-methylpent-3-enamide

C8H15N3O — CID 164587902

IUPAC(Z)-4-amino-2-ethylimino-N-methylpent-3-enamide
SMILESCC/N=C(/C=C(/C)N)C(=O)NC
InChIInChI=1S/C8H15N3O/c1-4-11-7(5-6(2)9)8(12)10-3/h5H,4,9H2,1-3H3,(H,10,12)/b6-5-,11-7-
InChIKeyPXRJTVGZZOKGDL-FUVGTJSASA-N
MW169.23 g/mol
LogP0.06
Rot. Bonds3

About (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide

(Z)-4-amino-2-ethylimino-N-methylpent-3-enamide (PubChem CID 164587902) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide.

Molecular Properties

Compound Name(Z)-4-amino-2-ethylimino-N-methylpent-3-enamide
PubChem CID164587902
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name(Z)-4-amino-2-ethylimino-N-methylpent-3-enamide
SMILESCC/N=C(/C=C(/C)N)C(=O)NC
InChIInChI=1S/C8H15N3O/c1-4-11-7(5-6(2)9)8(12)10-3/h5H,4,9H2,1-3H3,(H,10,12)/b6-5-,11-7-
InChIKeyPXRJTVGZZOKGDL-FUVGTJSASA-N
XLogP0.06
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-4-fluoro-N-methyl-2-methyliminopent-3-enamide
CID 171635643
N,6-dimethyl-2-oxo-1H-pyrimidine-4-carboxamide
CID 70657681
N,8-diethyl-1,4-diazocine-5-carboxamide
CID 77953105
(Z)-4-amino-N,N-dimethyl-2-methyliminopent-3-enamide
CID 118972787
(Z)-4-(4,6-dimethyl-2H-pyrimidin-1-yl)-N-methylbut-3-enamide
CID 121329879
(Z)-4-[[(Z)-4-methyliminopent-2-en-2-yl]amino]but-3-enamide
CID 121329897
N-[(Z)-2-methyliminopent-3-enyl]acetamide
CID 124182649
N,4-dimethyl-2-prop-1-en-2-yliminopent-3-enamide
CID 131997370
(Z)-4-amino-2-ethyliminopent-3-enoyl isothiocyanate
CID 131997617
(3Z)-2-ethenylimino-N-methylhexa-3,5-dienamide
CID 134297156
(2Z,6Z)-N-methyl-4,5-dihydroazocine-8-carboxamide
CID 141887723
N-(2,3-dihydropyridin-6-ylmethyl)acetamide
CID 143023357

Frequently Asked Questions

What is the IUPAC name of (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide?
The IUPAC name of (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide (CID 164587902) is (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide.
What is the SMILES notation for (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide?
The canonical SMILES for (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide is CC/N=C(/C=C(/C)N)C(=O)NC.
What is the InChIKey of (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide?
The InChIKey is PXRJTVGZZOKGDL-FUVGTJSASA-N. The full InChI is InChI=1S/C8H15N3O/c1-4-11-7(5-6(2)9)8(12)10-3/h5H,4,9H2,1-3H3,(H,10,12)/b6-5-,11-7-.
What are the key properties of (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide?
(Z)-4-amino-2-ethylimino-N-methylpent-3-enamide has a molecular weight of 169.23 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-amino-2-ethylimino-N-methylpent-3-enamide is sourced from PubChem (CID 164587902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).