(Z)-2-[methoxy(methyl)amino]but-2-enamide

C6H12N2O2 — CID 155059176

IUPAC(Z)-2-[methoxy(methyl)amino]but-2-enamide
SMILESC/C=C(/C(N)=O)N(C)OC
InChIInChI=1S/C6H12N2O2/c1-4-5(6(7)9)8(2)10-3/h4H,1-3H3,(H2,7,9)/b5-4-
InChIKeyHTYFCQKQCAJQQT-PLNGDYQASA-N
MW144.17 g/mol
LogP-0.13
Rot. Bonds3

About (Z)-2-[methoxy(methyl)amino]but-2-enamide

(Z)-2-[methoxy(methyl)amino]but-2-enamide (PubChem CID 155059176) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is (Z)-2-[methoxy(methyl)amino]but-2-enamide.

Molecular Properties

Compound Name(Z)-2-[methoxy(methyl)amino]but-2-enamide
PubChem CID155059176
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name(Z)-2-[methoxy(methyl)amino]but-2-enamide
SMILESC/C=C(/C(N)=O)N(C)OC
InChIInChI=1S/C6H12N2O2/c1-4-5(6(7)9)8(2)10-3/h4H,1-3H3,(H2,7,9)/b5-4-
InChIKeyHTYFCQKQCAJQQT-PLNGDYQASA-N
XLogP-0.13
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-[methoxy(methyl)amino]but-2-enamide?
The IUPAC name of (Z)-2-[methoxy(methyl)amino]but-2-enamide (CID 155059176) is (Z)-2-[methoxy(methyl)amino]but-2-enamide.
What is the SMILES notation for (Z)-2-[methoxy(methyl)amino]but-2-enamide?
The canonical SMILES for (Z)-2-[methoxy(methyl)amino]but-2-enamide is C/C=C(/C(N)=O)N(C)OC.
What is the InChIKey of (Z)-2-[methoxy(methyl)amino]but-2-enamide?
The InChIKey is HTYFCQKQCAJQQT-PLNGDYQASA-N. The full InChI is InChI=1S/C6H12N2O2/c1-4-5(6(7)9)8(2)10-3/h4H,1-3H3,(H2,7,9)/b5-4-.
What are the key properties of (Z)-2-[methoxy(methyl)amino]but-2-enamide?
(Z)-2-[methoxy(methyl)amino]but-2-enamide has a molecular weight of 144.17 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[methoxy(methyl)amino]but-2-enamide is sourced from PubChem (CID 155059176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).