4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one

C10H8N4O3 — CID 152778097

IUPAC4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one
SMILESNc1nc(-c2ccc(O)cc2)[nH]c(=O)c1N=O
InChIInChI=1S/C10H8N4O3/c11-8-7(14-17)10(16)13-9(12-8)5-1-3-6(15)4-2-5/h1-4,15H,(H3,11,12,13,16)
InChIKeyGFYXFPYSOONXBM-UHFFFAOYSA-N
MW232.20 g/mol
LogP1.12
Rot. Bonds2

About 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one

4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one (PubChem CID 152778097) has the molecular formula C10H8N4O3 and a molecular weight of 232.20 g/mol. Its IUPAC name is 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one
PubChem CID152778097
Molecular FormulaC10H8N4O3
Molecular Weight232.20 g/mol
Exact Mass232.06
IUPAC Name4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one
SMILESNc1nc(-c2ccc(O)cc2)[nH]c(=O)c1N=O
InChIInChI=1S/C10H8N4O3/c11-8-7(14-17)10(16)13-9(12-8)5-1-3-6(15)4-2-5/h1-4,15H,(H3,11,12,13,16)
InChIKeyGFYXFPYSOONXBM-UHFFFAOYSA-N
XLogP1.12
TPSA121.43 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-2-(3-hexoxyphenyl)-5-nitroso-1H-pyrimidin-6-one
CID 152778090
4-amino-2-(2,4-dimethoxyphenyl)-5-nitroso-1H-pyrimidin-6-one
CID 152778061
4-amino-2-(5-tert-butyl-2-methoxyphenyl)-5-nitroso-1H-pyrimidin-6-one
CID 152778104
2-(4-hydroxyphenyl)-6-(125I)iodo-3H-quinazolin-4-one
CID 135541903
8-bromo-2-(4-hydroxyphenyl)-3H-quinazolin-4-one
CID 178071051
4-amino-2-(5-fluoro-2-propoxyphenyl)-5-nitroso-1H-pyrimidin-6-one
CID 135967800
3-(4-hydroxyphenyl)-1,4-dihydro-1,2,4-triazol-5-one
CID 135957065
4-amino-2-(benzylamino)-5-nitroso-1H-pyrimidin-6-one
CID 137267829
4-amino-2-(3,4-dihydroxyphenyl)-5-ethyl-1H-pyrimidin-6-one
CID 136938581
4-amino-5-(2-hydroxyethyl)-2-phenyl-1H-pyrimidin-6-one
CID 137277391
4-(6-amino-1H-benzimidazol-2-yl)phenol
CID 763218
6-(4-hydroxyphenyl)-4-phenyl-1H-1,3,5-triazin-2-one
CID 156780127

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one?
The IUPAC name of 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one (CID 152778097) is 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one.
What is the SMILES notation for 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one?
The canonical SMILES for 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one is Nc1nc(-c2ccc(O)cc2)[nH]c(=O)c1N=O.
What is the InChIKey of 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one?
The InChIKey is GFYXFPYSOONXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O3/c11-8-7(14-17)10(16)13-9(12-8)5-1-3-6(15)4-2-5/h1-4,15H,(H3,11,12,13,16).
What are the key properties of 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one?
4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one has a molecular weight of 232.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(4-hydroxyphenyl)-5-nitroso-1H-pyrimidin-6-one is sourced from PubChem (CID 152778097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).