N'-hydroxy-3-methylpyridine-2-carboximidamide

C7H9N3O — CID 2794732

IUPACN'-hydroxy-3-methylpyridine-2-carboximidamide
SMILESCc1cccnc1C(N)=NO
InChIInChI=1S/C7H9N3O/c1-5-3-2-4-9-6(5)7(8)10-11/h2-4,11H,1H3,(H2,8,10)
InChIKeyUQDFGZCCSCDNSO-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.48
Rot. Bonds1

About N'-hydroxy-3-methylpyridine-2-carboximidamide

N'-hydroxy-3-methylpyridine-2-carboximidamide (PubChem CID 2794732) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is N'-hydroxy-3-methylpyridine-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-3-methylpyridine-2-carboximidamide
PubChem CID2794732
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC NameN'-hydroxy-3-methylpyridine-2-carboximidamide
SMILESCc1cccnc1C(N)=NO
InChIInChI=1S/C7H9N3O/c1-5-3-2-4-9-6(5)7(8)10-11/h2-4,11H,1H3,(H2,8,10)
InChIKeyUQDFGZCCSCDNSO-UHFFFAOYSA-N
XLogP0.48
TPSA71.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 N'-hydroxy-3-methylpyridine-2-carboximidamide?
The IUPAC name of N'-hydroxy-3-methylpyridine-2-carboximidamide (CID 2794732) is N'-hydroxy-3-methylpyridine-2-carboximidamide.
What is the SMILES notation for N'-hydroxy-3-methylpyridine-2-carboximidamide?
The canonical SMILES for N'-hydroxy-3-methylpyridine-2-carboximidamide is Cc1cccnc1C(N)=NO.
What is the InChIKey of N'-hydroxy-3-methylpyridine-2-carboximidamide?
The InChIKey is UQDFGZCCSCDNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-5-3-2-4-9-6(5)7(8)10-11/h2-4,11H,1H3,(H2,8,10).
What are the key properties of N'-hydroxy-3-methylpyridine-2-carboximidamide?
N'-hydroxy-3-methylpyridine-2-carboximidamide has a molecular weight of 151.17 g/mol, XLogP of 0.48, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-3-methylpyridine-2-carboximidamide is sourced from PubChem (CID 2794732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).