Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate
Basic information
- CAS
19056-88-3- Standard SMILES
CCOC(=O)C(=CNc1cc(C)ccn1)C(=O)OCC- InChIKey
YUYJTQOIHHNZBL-UHFFFAOYSA-N- Molecular formula
- C14H18N2O4
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.12665706
Names & identifiers
- Preferred name
- Diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioate
- IUPAC
- diethyl 2-[[(4-methyl-2-pyridinyl)amino]methylidene]propanedioate
- English name
- ((4-Methyl-2-pyridylamino)methylidene)malonic acid diethyl ester
- Molecular formula
- C14H18N2O4
- Molecular weight
- 278.3
Names & synonyms
19056-88-3diethyl {[(4-methylpyridin-2-yl)amino]methylidene}propanedioatediethyl 2-[[(4-methylpyridin-2-yl)amino]methylidene]propanedioateZINC100071518Propanedioic acid,2-[[(4-methyl-2-pyridinyl)amino]methylene]-, 1,3-diethyl esterSR-01000312068((4-METHYL-2-PYRIDYLAMINO)METHYLIDENE)MALONIC ACID DIETHYL ESTERNSC159400CBDivE_006580MLS000562368CHEMBL3209037DTXSID60303620
Show more names
diethyl(4-methyl-2-pyridylamino)methylenemalonate
HMS2580G042-[(4-Methyl-pyridin-2-ylamino)-methylene]-malonic acid diethyl esterMFCD00487268STK022430AKOS000613280NSC-159400SMR000175036ST002449
Database identifiers
- CAS
19056-88-3- PubChem CID
- 293095
- DTXSID
DTXSID60303620- ChEMBL
CHEMBL3209037
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Chemistry & industry
Upstream & downstream products
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Compound notes
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