N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C14H17N3O2S — CID 103734215

IUPACN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCCc1cnc(C(C)NC(=O)c2c[nH]c(C)cc2=O)s1
InChIInChI=1S/C14H17N3O2S/c1-4-10-6-16-14(20-10)9(3)17-13(19)11-7-15-8(2)5-12(11)18/h5-7,9H,4H2,1-3H3,(H,15,18)(H,17,19)
InChIKeyZRXBWYWNRBWYMX-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.19
Rot. Bonds4

About N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103734215) 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]-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103734215
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCCc1cnc(C(C)NC(=O)c2c[nH]c(C)cc2=O)s1
InChIInChI=1S/C14H17N3O2S/c1-4-10-6-16-14(20-10)9(3)17-13(19)11-7-15-8(2)5-12(11)18/h5-7,9H,4H2,1-3H3,(H,15,18)(H,17,19)
InChIKeyZRXBWYWNRBWYMX-UHFFFAOYSA-N
XLogP2.19
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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
N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-1,6-dimethyl-4-oxo-1,4-dihydropyridine-3-carboxamide
CID 121512746
N-[(1S)-1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 125157588
2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide
CID 118544297
N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 118544403
N-[1-(5-acetyl-1,3-thiazol-2-yl)ethyl]-2-ethenylimino-4-methylpent-3-enamide
CID 139564934
N-[(1S)-1-(5-acetyl-1,3-thiazol-2-yl)ethyl]-2,2-dimethylpropanamide
CID 144242211
ethane;N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 144654887
5-chloro-N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 71913866
N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 71994030
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-ethyl-1,3-thiazole-5-carboxamide
CID 72047098
4-oxo-N-[1-(1,3-thiazol-2-yl)ethyl]-1H-pyridine-3-carboxamide
CID 103337486

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 103734215) is N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide is CCc1cnc(C(C)NC(=O)c2c[nH]c(C)cc2=O)s1.
What is the InChIKey of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is ZRXBWYWNRBWYMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-4-10-6-16-14(20-10)9(3)17-13(19)11-7-15-8(2)5-12(11)18/h5-7,9H,4H2,1-3H3,(H,15,18)(H,17,19).
What are the key properties of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103734215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).