(Z)-N-methyl-2-(methylamino)but-2-enamide

C6H12N2O — CID 88684309

IUPAC(Z)-N-methyl-2-(methylamino)but-2-enamide
SMILESC/C=C(\NC)C(=O)NC
InChIInChI=1S/C6H12N2O/c1-4-5(7-2)6(9)8-3/h4,7H,1-3H3,(H,8,9)/b5-4-
InChIKeyPMZKZJWYUUIVJR-PLNGDYQASA-N
MW128.17 g/mol
LogP-0.14
Rot. Bonds2

About (Z)-N-methyl-2-(methylamino)but-2-enamide

(Z)-N-methyl-2-(methylamino)but-2-enamide (PubChem CID 88684309) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is (Z)-N-methyl-2-(methylamino)but-2-enamide.

Molecular Properties

Compound Name(Z)-N-methyl-2-(methylamino)but-2-enamide
PubChem CID88684309
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Name(Z)-N-methyl-2-(methylamino)but-2-enamide
SMILESC/C=C(\NC)C(=O)NC
InChIInChI=1S/C6H12N2O/c1-4-5(7-2)6(9)8-3/h4,7H,1-3H3,(H,8,9)/b5-4-
InChIKeyPMZKZJWYUUIVJR-PLNGDYQASA-N
XLogP-0.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N'-di((113C)methyl)oxamide
CID 169438737
(Z)-3-[formyl(methyl)amino]-N-methyl-2-(methylamino)prop-2-enamide
CID 142157976
2-fluoro-N-methylbut-2-enamide
CID 76578732
(3Z)-3-(methylamino)penta-1,3-dien-2-ol
CID 89219015
N-methyl-2-methylidenepent-3-enamide
CID 123693857
(Z)-2-acetamido-N,4-dimethylpent-2-enamide
CID 102329590
CID 59900877
CID 59900877
ethane;(E,3Z)-3-ethylidene-4-(methylamino)hex-4-enal
CID 143963041
CID 174070386
CID 174070386
(2E,4Z)-4-ethenyl-N-methylhexa-2,4-dien-3-amine
CID 126553029
(Z)-2-[(dimethylamino)methyl]-N-methylbut-2-enamide
CID 172623936
ethane;N'-methyloxamide
CID 176938398

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-2-(methylamino)but-2-enamide?
The IUPAC name of (Z)-N-methyl-2-(methylamino)but-2-enamide (CID 88684309) is (Z)-N-methyl-2-(methylamino)but-2-enamide.
What is the SMILES notation for (Z)-N-methyl-2-(methylamino)but-2-enamide?
The canonical SMILES for (Z)-N-methyl-2-(methylamino)but-2-enamide is C/C=C(\NC)C(=O)NC.
What is the InChIKey of (Z)-N-methyl-2-(methylamino)but-2-enamide?
The InChIKey is PMZKZJWYUUIVJR-PLNGDYQASA-N. The full InChI is InChI=1S/C6H12N2O/c1-4-5(7-2)6(9)8-3/h4,7H,1-3H3,(H,8,9)/b5-4-.
What are the key properties of (Z)-N-methyl-2-(methylamino)but-2-enamide?
(Z)-N-methyl-2-(methylamino)but-2-enamide has a molecular weight of 128.17 g/mol, XLogP of -0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-2-(methylamino)but-2-enamide is sourced from PubChem (CID 88684309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).