Cas no 19842-11-6 (4-Pyridinecarboxamide,3-ethyl-)
19842-11-6 structure
Product Name:4-Pyridinecarboxamide,3-ethyl-
CAS No:19842-11-6
MF:C8H10N2O
MW:150.177801609039
CID:123805
PubChem ID:15454016
Update Time:2025-04-18
4-Pyridinecarboxamide,3-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyridinecarboxamide,3-ethyl-
- Isonicotinamide, 3-ethyl- (8CI)
- SCHEMBL8594489
- Athylisonicotinsaureamid
- 19842-11-6
- 3-ethylpyridine-4-carboxamide
-
- Inchi： 1S/C8H10N2O/c1-2-6-5-10-4-3-7(6)8(9)11/h3-5H,2H2,1H3,(H2,9,11)
- InChI Key： UQELUVNZHZNFIV-UHFFFAOYSA-N
- SMILES： O=C(C1C=CN=CC=1CC)N
Computed Properties
- Exact Mass: 150.0794
- Monoisotopic Mass: 150.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 147
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.5
- Topological Polar Surface Area: 56?2
Experimental Properties
- PSA: 55.98
4-Pyridinecarboxamide,3-ethyl- Related Literature
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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