1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide

C8H10N4O2 — CID 83878714

IUPAC1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide
SMILESN/C(=N/O)c1cncn(C2CC2)c1=O
InChIInChI=1S/C8H10N4O2/c9-7(11-14)6-3-10-4-12(8(6)13)5-1-2-5/h3-5,14H,1-2H2,(H2,9,11)
InChIKeyKRVMUBAKXSATJU-UHFFFAOYSA-N
MW194.19 g/mol
LogP-0.33
Rot. Bonds2

About 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide

1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide (PubChem CID 83878714) has the molecular formula C8H10N4O2 and a molecular weight of 194.19 g/mol. Its IUPAC name is 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide.

Molecular Properties

Compound Name1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide
PubChem CID83878714
Molecular FormulaC8H10N4O2
Molecular Weight194.19 g/mol
Exact Mass194.08
IUPAC Name1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide
SMILESN/C(=N/O)c1cncn(C2CC2)c1=O
InChIInChI=1S/C8H10N4O2/c9-7(11-14)6-3-10-4-12(8(6)13)5-1-2-5/h3-5,14H,1-2H2,(H2,9,11)
InChIKeyKRVMUBAKXSATJU-UHFFFAOYSA-N
XLogP-0.33
TPSA93.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide?
The IUPAC name of 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide (CID 83878714) is 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide.
What is the SMILES notation for 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide?
The canonical SMILES for 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide is N/C(=N/O)c1cncn(C2CC2)c1=O.
What is the InChIKey of 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide?
The InChIKey is KRVMUBAKXSATJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O2/c9-7(11-14)6-3-10-4-12(8(6)13)5-1-2-5/h3-5,14H,1-2H2,(H2,9,11).
What are the key properties of 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide?
1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide has a molecular weight of 194.19 g/mol, XLogP of -0.33, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N'-hydroxy-6-oxopyrimidine-5-carboximidamide is sourced from PubChem (CID 83878714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).