5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide

C8H11N3O3 — CID 136501496

IUPAC5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide
SMILESCC(C)NC(=O)c1nc[nH]c(=O)c1O
InChIInChI=1S/C8H11N3O3/c1-4(2)11-7(13)5-6(12)8(14)10-3-9-5/h3-4,12H,1-2H3,(H,11,13)(H,9,10,14)
InChIKeyTZWNRNBUWVHXPA-UHFFFAOYSA-N
MW197.19 g/mol
LogP-0.39
Rot. Bonds2

About 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide

5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide (PubChem CID 136501496) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide
PubChem CID136501496
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC Name5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide
SMILESCC(C)NC(=O)c1nc[nH]c(=O)c1O
InChIInChI=1S/C8H11N3O3/c1-4(2)11-7(13)5-6(12)8(14)10-3-9-5/h3-4,12H,1-2H3,(H,11,13)(H,9,10,14)
InChIKeyTZWNRNBUWVHXPA-UHFFFAOYSA-N
XLogP-0.39
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-hydroxy-N-(2-methylpropyl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 136599278
N-cyclohexyl-5-hydroxy-6-oxo-1H-pyrimidine-4-carboxamide
CID 136599328
5-hydroxy-6-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 121320986
4-amino-N-propan-2-yl-1H-imidazole-5-carboxamide
CID 117213982
3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
CID 142553714
3,5-dioxo-N-propan-2-yl-2H-1,2,4-triazine-6-carboxamide
CID 110701952
5-N-(furan-2-ylmethyl)-4-N-propan-2-yl-1H-imidazole-4,5-dicarboxamide
CID 50755921
2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)-methylamino]-N-propan-2-ylacetamide
CID 136989946
5-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 110847845
5-amino-N-propan-2-yl-1,3-thiazole-4-carboxamide
CID 117214875
4-(propan-2-ylcarbamoyl)-1,3-thiazole-5-carboxylic acid
CID 117214967
4-N-propan-2-yl-5-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-imidazole-4,5-dicarboxamide
CID 46264374

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide?
The IUPAC name of 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide (CID 136501496) is 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide.
What is the SMILES notation for 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide?
The canonical SMILES for 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide is CC(C)NC(=O)c1nc[nH]c(=O)c1O.
What is the InChIKey of 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide?
The InChIKey is TZWNRNBUWVHXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1-4(2)11-7(13)5-6(12)8(14)10-3-9-5/h3-4,12H,1-2H3,(H,11,13)(H,9,10,14).
What are the key properties of 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide?
5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide has a molecular weight of 197.19 g/mol, XLogP of -0.39, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-6-oxo-N-propan-2-yl-1H-pyrimidine-4-carboxamide is sourced from PubChem (CID 136501496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).