5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide

C13H13N5O4 — CID 167992782

IUPAC5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide
SMILESCc1[nH]c(=O)[nH]c(=O)c1CC(=O)Nc1ccc(C(N)=O)nc1
InChIInChI=1S/C13H13N5O4/c1-6-8(12(21)18-13(22)16-6)4-10(19)17-7-2-3-9(11(14)20)15-5-7/h2-3,5H,4H2,1H3,(H2,14,20)(H,17,19)(H2,16,18,21,22)
InChIKeyRDDDIVIRBHULJF-UHFFFAOYSA-N
MW303.28 g/mol
LogP-0.95
Rot. Bonds4

About 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide

5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide (PubChem CID 167992782) has the molecular formula C13H13N5O4 and a molecular weight of 303.28 g/mol. Its IUPAC name is 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide
PubChem CID167992782
Molecular FormulaC13H13N5O4
Molecular Weight303.28 g/mol
Exact Mass303.10
IUPAC Name5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide
SMILESCc1[nH]c(=O)[nH]c(=O)c1CC(=O)Nc1ccc(C(N)=O)nc1
InChIInChI=1S/C13H13N5O4/c1-6-8(12(21)18-13(22)16-6)4-10(19)17-7-2-3-9(11(14)20)15-5-7/h2-3,5H,4H2,1H3,(H2,14,20)(H,17,19)(H2,16,18,21,22)
InChIKeyRDDDIVIRBHULJF-UHFFFAOYSA-N
XLogP-0.95
TPSA150.80 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.28
LogP ≤ 5-0.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[3-methyl-4-(trifluoromethyl)phenyl]acetamide
CID 166262998
N-(3-ethoxyphenyl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanamide
CID 154858210
2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 51894147
[4-[(Z)-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]hydrazinylidene]methyl]phenyl] acetate
CID 110526232
5-[[2-(2,4-dichlorophenoxy)acetyl]amino]pyridine-2-carboxamide
CID 167856049
(2-anilino-2-oxoethyl) 2-[(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)methylsulfanyl]acetate
CID 5127955
5-[(5-ethyl-3-methylfuran-2-carbonyl)amino]pyridine-2-carboxamide
CID 71908664
2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(Z)-[3-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 110526114
N-(4-acetylphenyl)-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 136890172
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-pyridin-3-ylacetamide
CID 3655714
2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(Z)-(1-methylindol-3-yl)methylideneamino]acetamide
CID 110526254
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 135896922

Frequently Asked Questions

What is the IUPAC name of 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide?
The IUPAC name of 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide (CID 167992782) is 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide.
What is the SMILES notation for 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide?
The canonical SMILES for 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide is Cc1[nH]c(=O)[nH]c(=O)c1CC(=O)Nc1ccc(C(N)=O)nc1.
What is the InChIKey of 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide?
The InChIKey is RDDDIVIRBHULJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O4/c1-6-8(12(21)18-13(22)16-6)4-10(19)17-7-2-3-9(11(14)20)15-5-7/h2-3,5H,4H2,1H3,(H2,14,20)(H,17,19)(H2,16,18,21,22).
What are the key properties of 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide?
5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide has a molecular weight of 303.28 g/mol, XLogP of -0.95, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetyl]amino]pyridine-2-carboxamide is sourced from PubChem (CID 167992782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).