2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide

C15H19N3O2S — CID 118544297

IUPAC2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide
SMILESCc1cc(=O)c(CNC(=O)C(C)(C)C)c(-c2nccs2)[nH]1
InChIInChI=1S/C15H19N3O2S/c1-9-7-11(19)10(8-17-14(20)15(2,3)4)12(18-9)13-16-5-6-21-13/h5-7H,8H2,1-4H3,(H,17,20)(H,18,19)
InChIKeyCYXFNVCAKOKDTA-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.47
Rot. Bonds3

About 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide

2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide (PubChem CID 118544297) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide
PubChem CID118544297
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide
SMILESCc1cc(=O)c(CNC(=O)C(C)(C)C)c(-c2nccs2)[nH]1
InChIInChI=1S/C15H19N3O2S/c1-9-7-11(19)10(8-17-14(20)15(2,3)4)12(18-9)13-16-5-6-21-13/h5-7H,8H2,1-4H3,(H,17,20)(H,18,19)
InChIKeyCYXFNVCAKOKDTA-UHFFFAOYSA-N
XLogP2.47
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide with MolForge

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Related Compounds

N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-(1,3-thiazol-2-yl)propanamide
CID 72047880
1-cyclopropyl-N,6-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)pyridine-3-carboxamide
CID 128406769
N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 118544403
N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]carbamoyl iodide
CID 132022171
ethane;N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 144654887
6-methyl-4-oxo-5-(1,3-thiazol-2-yl)-1H-pyridine-3-carboxamide
CID 175841842
1-Methyl-6-oxo-2-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 176302127
1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-(1,3-thiazol-2-ylmethyl)urea
CID 53514182
6-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-pyridine-3-carboxamide
CID 60972270
6-oxo-N-[1-(1,3-thiazol-2-yl)ethyl]-1H-pyridine-3-carboxamide
CID 63612073
6-oxo-N-[1-(1,3-thiazol-2-yl)propyl]-1H-pyridine-3-carboxamide
CID 64481606
6-oxo-N-[2-(1,3-thiazol-2-yl)butan-2-yl]-1H-pyridine-3-carboxamide
CID 72005657

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide (CID 118544297) is 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide is Cc1cc(=O)c(CNC(=O)C(C)(C)C)c(-c2nccs2)[nH]1.
What is the InChIKey of 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide?
The InChIKey is CYXFNVCAKOKDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-9-7-11(19)10(8-17-14(20)15(2,3)4)12(18-9)13-16-5-6-21-13/h5-7H,8H2,1-4H3,(H,17,20)(H,18,19).
What are the key properties of 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide?
2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide has a molecular weight of 305.40 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide is sourced from PubChem (CID 118544297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).