2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide

C11H10N4O3 — CID 118313501

IUPAC2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide
SMILESNc1nc(O)c(C(=O)Nc2ccccc2)c(=O)[nH]1
InChIInChI=1S/C11H10N4O3/c12-11-14-9(17)7(10(18)15-11)8(16)13-6-4-2-1-3-5-6/h1-5H,(H,13,16)(H4,12,14,15,17,18)
InChIKeyRQKLRBYEXYMWDQ-UHFFFAOYSA-N
MW246.23 g/mol
LogP0.31
Rot. Bonds2

About 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide

2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide (PubChem CID 118313501) has the molecular formula C11H10N4O3 and a molecular weight of 246.23 g/mol. Its IUPAC name is 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide
PubChem CID118313501
Molecular FormulaC11H10N4O3
Molecular Weight246.23 g/mol
Exact Mass246.08
IUPAC Name2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide
SMILESNc1nc(O)c(C(=O)Nc2ccccc2)c(=O)[nH]1
InChIInChI=1S/C11H10N4O3/c12-11-14-9(17)7(10(18)15-11)8(16)13-6-4-2-1-3-5-6/h1-5H,(H,13,16)(H4,12,14,15,17,18)
InChIKeyRQKLRBYEXYMWDQ-UHFFFAOYSA-N
XLogP0.31
TPSA121.10 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 50.31
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-2-[4-hydroxy-6-oxo-5-(phenylcarbamothioyl)-1H-pyrimidin-2-yl]-6-oxo-N-phenyl-1H-pyrimidine-5-carbothioamide
CID 135543818
N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-4-chlorobenzamide
CID 66758533
4-methyl-2-oxo-N-phenyl-1H-quinoline-3-carboxamide
CID 24951306
2,5-diamino-4-anilino-1H-pyrimidin-6-one
CID 135850742
4-oxo-N-phenyl-3H-quinazoline-2-carboxamide
CID 135794299
1-(3-bromophenyl)-6-hydroxy-2,4-dioxo-N-phenylpyrimidine-5-carboxamide
CID 66522731
6-hydroxy-2,4-dioxo-N-phenyl-1-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide
CID 66522790
2,3,4,5,6-pentamethyl-N-phenylbenzamide
CID 60629319
1-(2,3-dimethylphenyl)-6-hydroxy-2,4-dioxo-N-phenylpyrimidine-5-carboxamide
CID 66522750
2,4-dichloro-N-phenylquinoline-3-carboxamide
CID 2786668
2-oxo-N-phenyl-3H-1,3,4-thiadiazole-5-carboxamide
CID 12025379
N-[4-amino-2-(2-anilino-2-oxoethyl)sulfanyl-6-oxo-1H-pyrimidin-5-yl]benzamide
CID 135714738

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
The IUPAC name of 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide (CID 118313501) is 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
The canonical SMILES for 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide is Nc1nc(O)c(C(=O)Nc2ccccc2)c(=O)[nH]1.
What is the InChIKey of 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
The InChIKey is RQKLRBYEXYMWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O3/c12-11-14-9(17)7(10(18)15-11)8(16)13-6-4-2-1-3-5-6/h1-5H,(H,13,16)(H4,12,14,15,17,18).
What are the key properties of 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide?
2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide has a molecular weight of 246.23 g/mol, XLogP of 0.31, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-hydroxy-6-oxo-N-phenyl-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 118313501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).