1-amino-2H-pyrimidine-2-carboxamide

C5H8N4O — CID 151263393

IUPAC1-amino-2H-pyrimidine-2-carboxamide
SMILESNC(=O)C1N=CC=CN1N
InChIInChI=1S/C5H8N4O/c6-4(10)5-8-2-1-3-9(5)7/h1-3,5H,7H2,(H2,6,10)
InChIKeyNUVBDKFPJLALMR-UHFFFAOYSA-N
MW140.15 g/mol
LogP-1.43
Rot. Bonds1

About 1-amino-2H-pyrimidine-2-carboxamide

1-amino-2H-pyrimidine-2-carboxamide (PubChem CID 151263393) has the molecular formula C5H8N4O and a molecular weight of 140.15 g/mol. Its IUPAC name is 1-amino-2H-pyrimidine-2-carboxamide.

Molecular Properties

Compound Name1-amino-2H-pyrimidine-2-carboxamide
PubChem CID151263393
Molecular FormulaC5H8N4O
Molecular Weight140.15 g/mol
Exact Mass140.07
IUPAC Name1-amino-2H-pyrimidine-2-carboxamide
SMILESNC(=O)C1N=CC=CN1N
InChIInChI=1S/C5H8N4O/c6-4(10)5-8-2-1-3-9(5)7/h1-3,5H,7H2,(H2,6,10)
InChIKeyNUVBDKFPJLALMR-UHFFFAOYSA-N
XLogP-1.43
TPSA84.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.15
LogP ≤ 5-1.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-2H-pyrimidine-2-carboxamide?
The IUPAC name of 1-amino-2H-pyrimidine-2-carboxamide (CID 151263393) is 1-amino-2H-pyrimidine-2-carboxamide.
What is the SMILES notation for 1-amino-2H-pyrimidine-2-carboxamide?
The canonical SMILES for 1-amino-2H-pyrimidine-2-carboxamide is NC(=O)C1N=CC=CN1N.
What is the InChIKey of 1-amino-2H-pyrimidine-2-carboxamide?
The InChIKey is NUVBDKFPJLALMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O/c6-4(10)5-8-2-1-3-9(5)7/h1-3,5H,7H2,(H2,6,10).
What are the key properties of 1-amino-2H-pyrimidine-2-carboxamide?
1-amino-2H-pyrimidine-2-carboxamide has a molecular weight of 140.15 g/mol, XLogP of -1.43, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2H-pyrimidine-2-carboxamide is sourced from PubChem (CID 151263393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).