N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide

C5H5N3O3 — CID 45071810

IUPACN-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide
SMILESO=CNc1c(O)nc[nH]c1=O
InChIInChI=1S/C5H5N3O3/c9-2-8-3-4(10)6-1-7-5(3)11/h1-2H,(H,8,9)(H2,6,7,10,11)
InChIKeyALCYUJIBYPTBCJ-UHFFFAOYSA-N
MW155.11 g/mol
LogP-0.96
Rot. Bonds2

About N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide

N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide (PubChem CID 45071810) has the molecular formula C5H5N3O3 and a molecular weight of 155.11 g/mol. Its IUPAC name is N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide.

Molecular Properties

Compound NameN-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide
PubChem CID45071810
Molecular FormulaC5H5N3O3
Molecular Weight155.11 g/mol
Exact Mass155.03
IUPAC NameN-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide
SMILESO=CNc1c(O)nc[nH]c1=O
InChIInChI=1S/C5H5N3O3/c9-2-8-3-4(10)6-1-7-5(3)11/h1-2H,(H,8,9)(H2,6,7,10,11)
InChIKeyALCYUJIBYPTBCJ-UHFFFAOYSA-N
XLogP-0.96
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.11
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide?
The IUPAC name of N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide (CID 45071810) is N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide.
What is the SMILES notation for N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide?
The canonical SMILES for N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide is O=CNc1c(O)nc[nH]c1=O.
What is the InChIKey of N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide?
The InChIKey is ALCYUJIBYPTBCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N3O3/c9-2-8-3-4(10)6-1-7-5(3)11/h1-2H,(H,8,9)(H2,6,7,10,11).
What are the key properties of N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide?
N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide has a molecular weight of 155.11 g/mol, XLogP of -0.96, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-6-oxo-1H-pyrimidin-5-yl)formamide is sourced from PubChem (CID 45071810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).