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

C10H11N3OS — CID 165472234

IUPAC5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one
SMILESCc1ncc(Cn2cc(N)ccc2=O)s1
InChIInChI=1S/C10H11N3OS/c1-7-12-4-9(15-7)6-13-5-8(11)2-3-10(13)14/h2-5H,6,11H2,1H3
InChIKeyMDDUGXQVHNBXFG-UHFFFAOYSA-N
MW221.29 g/mol
LogP1.24
Rot. Bonds2

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

5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one (PubChem CID 165472234) has the molecular formula C10H11N3OS and a molecular weight of 221.29 g/mol. Its IUPAC name is 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one
PubChem CID165472234
Molecular FormulaC10H11N3OS
Molecular Weight221.29 g/mol
Exact Mass221.06
IUPAC Name5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one
SMILESCc1ncc(Cn2cc(N)ccc2=O)s1
InChIInChI=1S/C10H11N3OS/c1-7-12-4-9(15-7)6-13-5-8(11)2-3-10(13)14/h2-5H,6,11H2,1H3
InChIKeyMDDUGXQVHNBXFG-UHFFFAOYSA-N
XLogP1.24
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-methyl-1,3-thiazol-5-yl)methyl]-1,3-dihydroisoindol-5-amine
CID 54962658
5-[[3,5-bis[(2-methyl-1,3-thiazol-5-yl)methyl]-1,3,5-triazinan-1-yl]methyl]-2-methyl-1,3-thiazole
CID 59815005
6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine
CID 63021346
5-bromo-1-[[2-(ethylamino)-1,3-thiazol-5-yl]methyl]pyridin-2-one
CID 79774454
1-[(2-methyl-1,3-thiazol-5-yl)methyl]indazol-5-amine
CID 68619298
1-(2-methoxyethyl)-5-[(2-methyl-1,3-thiazol-5-yl)methylamino]pyridin-2-one
CID 54868560
4-bromo-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrole-2-carboxylic acid
CID 114604494
1-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrol-3-yl]ethanone
CID 79106608
2-(5-amino-2-oxo-1-pyridinyl)-N-[(5-methylpyrazin-2-yl)methyl]acetamide
CID 62848412
4-chloro-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrazol-5-amine
CID 130580306
5-amino-1-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethyl]pyridin-2-one
CID 62305299
5-nitro-1-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]methyl]pyridin-2-one
CID 78789608

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one (CID 165472234) is 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one is Cc1ncc(Cn2cc(N)ccc2=O)s1.
What is the InChIKey of 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one?
The InChIKey is MDDUGXQVHNBXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-7-12-4-9(15-7)6-13-5-8(11)2-3-10(13)14/h2-5H,6,11H2,1H3.
What are the key properties of 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one?
5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one has a molecular weight of 221.29 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-2-one is sourced from PubChem (CID 165472234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).