(Z)-3-amino-3-formamido-N-methylprop-2-enamide

C5H9N3O2 — CID 129112313

IUPAC(Z)-3-amino-3-formamido-N-methylprop-2-enamide
SMILESCNC(=O)/C=C(/N)NC=O
InChIInChI=1S/C5H9N3O2/c1-7-5(10)2-4(6)8-3-9/h2-3H,6H2,1H3,(H,7,10)(H,8,9)/b4-2-
InChIKeyWSIPUUUVIFJCAD-RQOWECAXSA-N
MW143.15 g/mol
LogP-1.72
Rot. Bonds3

About (Z)-3-amino-3-formamido-N-methylprop-2-enamide

(Z)-3-amino-3-formamido-N-methylprop-2-enamide (PubChem CID 129112313) has the molecular formula C5H9N3O2 and a molecular weight of 143.15 g/mol. Its IUPAC name is (Z)-3-amino-3-formamido-N-methylprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-amino-3-formamido-N-methylprop-2-enamide
PubChem CID129112313
Molecular FormulaC5H9N3O2
Molecular Weight143.15 g/mol
Exact Mass143.07
IUPAC Name(Z)-3-amino-3-formamido-N-methylprop-2-enamide
SMILESCNC(=O)/C=C(/N)NC=O
InChIInChI=1S/C5H9N3O2/c1-7-5(10)2-4(6)8-3-9/h2-3H,6H2,1H3,(H,7,10)(H,8,9)/b4-2-
InChIKeyWSIPUUUVIFJCAD-RQOWECAXSA-N
XLogP-1.72
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-1.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-3-formamido-N-methylprop-2-enamide?
The IUPAC name of (Z)-3-amino-3-formamido-N-methylprop-2-enamide (CID 129112313) is (Z)-3-amino-3-formamido-N-methylprop-2-enamide.
What is the SMILES notation for (Z)-3-amino-3-formamido-N-methylprop-2-enamide?
The canonical SMILES for (Z)-3-amino-3-formamido-N-methylprop-2-enamide is CNC(=O)/C=C(/N)NC=O.
What is the InChIKey of (Z)-3-amino-3-formamido-N-methylprop-2-enamide?
The InChIKey is WSIPUUUVIFJCAD-RQOWECAXSA-N. The full InChI is InChI=1S/C5H9N3O2/c1-7-5(10)2-4(6)8-3-9/h2-3H,6H2,1H3,(H,7,10)(H,8,9)/b4-2-.
What are the key properties of (Z)-3-amino-3-formamido-N-methylprop-2-enamide?
(Z)-3-amino-3-formamido-N-methylprop-2-enamide has a molecular weight of 143.15 g/mol, XLogP of -1.72, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-3-formamido-N-methylprop-2-enamide is sourced from PubChem (CID 129112313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).