N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide

C14H17N3O2S — CID 103734226

IUPACN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCc1cnc(C(C)NC(=O)c2ccn(C)c(=O)c2)s1
InChIInChI=1S/C14H17N3O2S/c1-4-11-8-15-14(20-11)9(2)16-13(19)10-5-6-17(3)12(18)7-10/h5-9H,4H2,1-3H3,(H,16,19)
InChIKeyODOKDJQNYRTKEX-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.90
Rot. Bonds4

About N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 103734226) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID103734226
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCc1cnc(C(C)NC(=O)c2ccn(C)c(=O)c2)s1
InChIInChI=1S/C14H17N3O2S/c1-4-11-8-15-14(20-11)9(2)16-13(19)10-5-6-17(3)12(18)7-10/h5-9H,4H2,1-3H3,(H,16,19)
InChIKeyODOKDJQNYRTKEX-UHFFFAOYSA-N
XLogP1.90
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,2-dimethyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 75389323
1-[2-(5-Ethyl-1,3-thiazol-2-yl)ethyl]-3-(1-methyl-2-oxo-3-pyridinyl)urea
CID 72117534
1-methyl-2-oxo-N-(1,3-thiazol-2-ylmethyl)pyridine-4-carboxamide
CID 75461584
(2E,4E)-2-ethenyl-4-fluoro-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]hexa-2,4-dienamide
CID 143454822
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 86836187
N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]-6-oxo-5-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 138026456
(2E)-2-[(Z)-but-2-en-2-yl]-N-[2-(4,4-difluoropiperidin-1-yl)-2-(2-methyl-1,3-thiazol-5-yl)ethyl]-3-methylpenta-2,4-dienamide
CID 153669038
N-cyclohexyl-1-[2-[2-(5-methyl-1,3-thiazol-2-yl)ethylamino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 92635167
(E)-2-ethenylimino-4-methyl-N-[1-(5-prop-1-en-2-yl-1,3-thiazol-2-yl)ethyl]oct-3-en-5-ynamide
CID 129090931
N-[1-(5-acetyl-1,3-thiazol-2-yl)ethyl]-2-ethenylimino-4-methylpent-3-enamide
CID 139564934
1-[2-(5-Ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone
CID 142075753
2,5-dimethyl-1,3-thiazole;ethane;(2E,4E)-2-ethyl-4-formamido-5-methylhepta-2,4,6-trienamide
CID 177014050

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 103734226) is N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide is CCc1cnc(C(C)NC(=O)c2ccn(C)c(=O)c2)s1.
What is the InChIKey of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is ODOKDJQNYRTKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-4-11-8-15-14(20-11)9(2)16-13(19)10-5-6-17(3)12(18)7-10/h5-9H,4H2,1-3H3,(H,16,19).
What are the key properties of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103734226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).