(Z)-3-amino-2-(methylamino)prop-2-enamide

C4H9N3O — CID 89333822

IUPAC(Z)-3-amino-2-(methylamino)prop-2-enamide
SMILESCN/C(=C\N)C(N)=O
InChIInChI=1S/C4H9N3O/c1-7-3(2-5)4(6)8/h2,7H,5H2,1H3,(H2,6,8)/b3-2-
InChIKeyGJJKCAJUQOXGLS-IHWYPQMZSA-N
MW115.14 g/mol
LogP-1.51
Rot. Bonds2

About (Z)-3-amino-2-(methylamino)prop-2-enamide

(Z)-3-amino-2-(methylamino)prop-2-enamide (PubChem CID 89333822) has the molecular formula C4H9N3O and a molecular weight of 115.14 g/mol. Its IUPAC name is (Z)-3-amino-2-(methylamino)prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-amino-2-(methylamino)prop-2-enamide
PubChem CID89333822
Molecular FormulaC4H9N3O
Molecular Weight115.14 g/mol
Exact Mass115.07
IUPAC Name(Z)-3-amino-2-(methylamino)prop-2-enamide
SMILESCN/C(=C\N)C(N)=O
InChIInChI=1S/C4H9N3O/c1-7-3(2-5)4(6)8/h2,7H,5H2,1H3,(H2,6,8)/b3-2-
InChIKeyGJJKCAJUQOXGLS-IHWYPQMZSA-N
XLogP-1.51
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.14
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-2-(methylamino)prop-2-enamide?
The IUPAC name of (Z)-3-amino-2-(methylamino)prop-2-enamide (CID 89333822) is (Z)-3-amino-2-(methylamino)prop-2-enamide.
What is the SMILES notation for (Z)-3-amino-2-(methylamino)prop-2-enamide?
The canonical SMILES for (Z)-3-amino-2-(methylamino)prop-2-enamide is CN/C(=C\N)C(N)=O.
What is the InChIKey of (Z)-3-amino-2-(methylamino)prop-2-enamide?
The InChIKey is GJJKCAJUQOXGLS-IHWYPQMZSA-N. The full InChI is InChI=1S/C4H9N3O/c1-7-3(2-5)4(6)8/h2,7H,5H2,1H3,(H2,6,8)/b3-2-.
What are the key properties of (Z)-3-amino-2-(methylamino)prop-2-enamide?
(Z)-3-amino-2-(methylamino)prop-2-enamide has a molecular weight of 115.14 g/mol, XLogP of -1.51, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-2-(methylamino)prop-2-enamide is sourced from PubChem (CID 89333822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).