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

C6H11N3O — CID 130227471

IUPAC(Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide
SMILESC/C=N/C(=C\NC)C(N)=O
InChIInChI=1S/C6H11N3O/c1-3-9-5(4-8-2)6(7)10/h3-4,8H,1-2H3,(H2,7,10)/b5-4-,9-3+
InChIKeyWDXCLVSYQMWPRI-SMPMWSNWSA-N
MW141.17 g/mol
LogP-0.38
Rot. Bonds3

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

(Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide (PubChem CID 130227471) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide.

Molecular Properties

Compound Name(Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide
PubChem CID130227471
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name(Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide
SMILESC/C=N/C(=C\NC)C(N)=O
InChIInChI=1S/C6H11N3O/c1-3-9-5(4-8-2)6(7)10/h3-4,8H,1-2H3,(H2,7,10)/b5-4-,9-3+
InChIKeyWDXCLVSYQMWPRI-SMPMWSNWSA-N
XLogP-0.38
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide?
The IUPAC name of (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide (CID 130227471) is (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide.
What is the SMILES notation for (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide?
The canonical SMILES for (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide is C/C=N/C(=C\NC)C(N)=O.
What is the InChIKey of (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide?
The InChIKey is WDXCLVSYQMWPRI-SMPMWSNWSA-N. The full InChI is InChI=1S/C6H11N3O/c1-3-9-5(4-8-2)6(7)10/h3-4,8H,1-2H3,(H2,7,10)/b5-4-,9-3+.
What are the key properties of (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide?
(Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide has a molecular weight of 141.17 g/mol, XLogP of -0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(ethylideneamino)-3-(methylamino)prop-2-enamide is sourced from PubChem (CID 130227471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).