1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide

C18H24N4O2S — CID 172673669

IUPAC1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide
SMILESCSc1ncccc1NC(=O)c1c(C)ccn(C(C)CN(C)C)c1=O
InChIInChI=1S/C18H24N4O2S/c1-12-8-10-22(13(2)11-21(3)4)18(24)15(12)16(23)20-14-7-6-9-19-17(14)25-5/h6-10,13H,11H2,1-5H3,(H,20,23)
InChIKeyBJZFRRYFHHYEDO-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.65
Rot. Bonds6

About 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide

1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide (PubChem CID 172673669) has the molecular formula C18H24N4O2S and a molecular weight of 360.48 g/mol. Its IUPAC name is 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide
PubChem CID172673669
Molecular FormulaC18H24N4O2S
Molecular Weight360.48 g/mol
Exact Mass360.16
IUPAC Name1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide
SMILESCSc1ncccc1NC(=O)c1c(C)ccn(C(C)CN(C)C)c1=O
InChIInChI=1S/C18H24N4O2S/c1-12-8-10-22(13(2)11-21(3)4)18(24)15(12)16(23)20-14-7-6-9-19-17(14)25-5/h6-10,13H,11H2,1-5H3,(H,20,23)
InChIKeyBJZFRRYFHHYEDO-UHFFFAOYSA-N
XLogP2.65
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxo-N-(4-pyridin-3-yloxyphenyl)pyridine-3-carboxamide
CID 172662023
1-[1-(dimethylamino)propan-2-yl]-N-[4-(furan-2-ylmethoxy)phenyl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172665805
methyl 1-[[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]amino]cyclopropane-1-carboxylate
CID 172665005
1-[1-(dimethylamino)propan-2-yl]-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172667783
1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methyl-1-propylbenzimidazol-5-yl)-2-oxopyridine-3-carboxamide
CID 172661807
1-[1-(dimethylamino)propan-2-yl]-N-(8-fluoro-3-oxo-4H-1,4-benzoxazin-6-yl)-4-methyl-2-oxopyridine-3-carboxamide
CID 172660730
1-[1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carbonyl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 172667558
N-[1-[(4-chlorophenyl)methyl]cyclopropyl]-1-[1-(dimethylamino)propan-2-yl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172658972
1-[1-(dimethylamino)propan-2-yl]-N-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-4-methyl-2-oxopyridine-3-carboxamide
CID 172662811
N-[3-(dimethylcarbamoyl)-2-methylphenyl]-4-methyl-2-oxo-1-(1-phenylethyl)pyridine-3-carboxamide
CID 172665792
N-(2-methylsulfanyl-3-pyridinyl)-7-oxo-[1,3]thiazolo[3,2-a]pyrimidine-5-carboxamide
CID 157017479
N-[2-methyl-5-[(2-methylsulfanyl-3-pyridinyl)carbamoyl]phenyl]-1,2-thiazole-5-carboxamide
CID 172657474

Frequently Asked Questions

What is the IUPAC name of 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide (CID 172673669) is 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide is CSc1ncccc1NC(=O)c1c(C)ccn(C(C)CN(C)C)c1=O.
What is the InChIKey of 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide?
The InChIKey is BJZFRRYFHHYEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2S/c1-12-8-10-22(13(2)11-21(3)4)18(24)15(12)16(23)20-14-7-6-9-19-17(14)25-5/h6-10,13H,11H2,1-5H3,(H,20,23).
What are the key properties of 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide?
1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide has a molecular weight of 360.48 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(dimethylamino)propan-2-yl]-4-methyl-N-(2-methylsulfanyl-3-pyridinyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172673669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).