2-amino-N-hydroxypyrimidine-5-carboxamide

C5H6N4O2 — CID 87814574

IUPAC2-amino-N-hydroxypyrimidine-5-carboxamide
SMILESNc1ncc(C(=O)NO)cn1
InChIInChI=1S/C5H6N4O2/c6-5-7-1-3(2-8-5)4(10)9-11/h1-2,11H,(H,9,10)(H2,6,7,8)
InChIKeyOEXRLJIEPZXNQN-UHFFFAOYSA-N
MW154.13 g/mol
LogP-0.82
Rot. Bonds1

About 2-amino-N-hydroxypyrimidine-5-carboxamide

2-amino-N-hydroxypyrimidine-5-carboxamide (PubChem CID 87814574) has the molecular formula C5H6N4O2 and a molecular weight of 154.13 g/mol. Its IUPAC name is 2-amino-N-hydroxypyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-amino-N-hydroxypyrimidine-5-carboxamide
PubChem CID87814574
Molecular FormulaC5H6N4O2
Molecular Weight154.13 g/mol
Exact Mass154.05
IUPAC Name2-amino-N-hydroxypyrimidine-5-carboxamide
SMILESNc1ncc(C(=O)NO)cn1
InChIInChI=1S/C5H6N4O2/c6-5-7-1-3(2-8-5)4(10)9-11/h1-2,11H,(H,9,10)(H2,6,7,8)
InChIKeyOEXRLJIEPZXNQN-UHFFFAOYSA-N
XLogP-0.82
TPSA101.13 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.13
LogP ≤ 5-0.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-hydroxypyrimidine-5-carboxamide?
The IUPAC name of 2-amino-N-hydroxypyrimidine-5-carboxamide (CID 87814574) is 2-amino-N-hydroxypyrimidine-5-carboxamide.
What is the SMILES notation for 2-amino-N-hydroxypyrimidine-5-carboxamide?
The canonical SMILES for 2-amino-N-hydroxypyrimidine-5-carboxamide is Nc1ncc(C(=O)NO)cn1.
What is the InChIKey of 2-amino-N-hydroxypyrimidine-5-carboxamide?
The InChIKey is OEXRLJIEPZXNQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4O2/c6-5-7-1-3(2-8-5)4(10)9-11/h1-2,11H,(H,9,10)(H2,6,7,8).
What are the key properties of 2-amino-N-hydroxypyrimidine-5-carboxamide?
2-amino-N-hydroxypyrimidine-5-carboxamide has a molecular weight of 154.13 g/mol, XLogP of -0.82, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-hydroxypyrimidine-5-carboxamide is sourced from PubChem (CID 87814574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).