5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one

C10H10BrN3OS — CID 86683953

IUPAC5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one
SMILESCc1cnc(Nc2cc(Br)cn(C)c2=O)s1
InChIInChI=1S/C10H10BrN3OS/c1-6-4-12-10(16-6)13-8-3-7(11)5-14(2)9(8)15/h3-5H,1-2H3,(H,12,13)
InChIKeyDTIDBOMYTNOPDV-UHFFFAOYSA-N
MW300.18 g/mol
LogP2.66
Rot. Bonds2

About 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one

5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one (PubChem CID 86683953) has the molecular formula C10H10BrN3OS and a molecular weight of 300.18 g/mol. Its IUPAC name is 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one.

Molecular Properties

Compound Name5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one
PubChem CID86683953
Molecular FormulaC10H10BrN3OS
Molecular Weight300.18 g/mol
Exact Mass298.97
IUPAC Name5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one
SMILESCc1cnc(Nc2cc(Br)cn(C)c2=O)s1
InChIInChI=1S/C10H10BrN3OS/c1-6-4-12-10(16-6)13-8-3-7(11)5-14(2)9(8)15/h3-5H,1-2H3,(H,12,13)
InChIKeyDTIDBOMYTNOPDV-UHFFFAOYSA-N
XLogP2.66
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.18
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-hydroxy-N-(5-methylthiazol-2-yl)pyrimidine-4-carboxamide
CID 136666419
N-(5-methyl-1,3-thiazol-2-yl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 31939975
1-Methyl-3-(5-methylthiazol-2-ylamino)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2(1H)-one
CID 86683955
5-ethenyl-2-methyl-N-(5-methyl-1,3-thiazol-2-yl)-6-prop-1-enylthiazine-3-carboxamide
CID 90909060
3-Amino-5-chloro-1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
CID 137449781
3-Amino-1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
CID 137450282
1-(5-Methyl-1,3-thiazol-2-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 137457266
5-Chloro-1-(5-methyl-1,3-thiazol-2-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 139390339
1-Methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one
CID 141210565
Ethane;3-(methylamino)-1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
CID 142523302
3-(Methylamino)-1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
CID 142523303
3-Bromo-1-(5-methyl-1,3-thiazol-2-yl)pyridin-2-one
CID 146643685

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one?
The IUPAC name of 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one (CID 86683953) is 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one.
What is the SMILES notation for 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one?
The canonical SMILES for 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one is Cc1cnc(Nc2cc(Br)cn(C)c2=O)s1.
What is the InChIKey of 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one?
The InChIKey is DTIDBOMYTNOPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3OS/c1-6-4-12-10(16-6)13-8-3-7(11)5-14(2)9(8)15/h3-5H,1-2H3,(H,12,13).
What are the key properties of 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one?
5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one has a molecular weight of 300.18 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-methyl-3-[(5-methyl-1,3-thiazol-2-yl)amino]pyridin-2-one is sourced from PubChem (CID 86683953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).