N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide

C10H11N5O — CID 137013664

IUPACN'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide
SMILESCc1cc(/C(N)=N/O)cc(-n2cccn2)n1
InChIInChI=1S/C10H11N5O/c1-7-5-8(10(11)14-16)6-9(13-7)15-4-2-3-12-15/h2-6,16H,1H3,(H2,11,14)
InChIKeyMHEIYXAGVCWQCM-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.67
Rot. Bonds2

About N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide

N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide (PubChem CID 137013664) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide
PubChem CID137013664
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC NameN'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide
SMILESCc1cc(/C(N)=N/O)cc(-n2cccn2)n1
InChIInChI=1S/C10H11N5O/c1-7-5-8(10(11)14-16)6-9(13-7)15-4-2-3-12-15/h2-6,16H,1H3,(H2,11,14)
InChIKeyMHEIYXAGVCWQCM-UHFFFAOYSA-N
XLogP0.67
TPSA89.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.67
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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Related Compounds

N'-hydroxy-4,6-dimethyl-2-pyrazol-1-ylpyridine-3-carboximidamide
CID 61175028
4-methyl-6-pyrazol-1-ylpyrimidin-2-amine
CID 14157472
2-(3,5-diethylpyrazol-1-yl)-N'-hydroxy-6-methylpyridine-4-carboximidamide
CID 137013688
N'-hydroxy-2-methyl-6-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyridine-4-carboximidamide
CID 137013603
N'-hydroxy-2-(4-methoxypiperidin-1-yl)-6-methylpyridine-4-carboximidamide
CID 137013400
N'-hydroxy-5,6-dimethyl-3-pyrazol-1-ylpyridazine-4-carboximidamide
CID 136924844
2-(2,4-dimethyl-1,4-diazepan-1-yl)-N'-hydroxy-6-methylpyridine-4-carboximidamide
CID 136726380
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N'-hydroxy-6-methylpyridine-4-carboximidamide
CID 137013920
N'-hydroxy-2-methyl-6-(1-phenylethoxy)pyridine-4-carboximidamide
CID 137013719
2-(4-fluorophenyl)sulfanyl-N'-hydroxy-6-methylpyridine-4-carboximidamide
CID 137013878
N'-hydroxy-1-(2-pyrazol-1-ylethyl)indole-5-carboximidamide
CID 107920822
N'-hydroxy-2-methyl-6-(3-phenylpropoxy)pyridine-4-carboximidamide
CID 137013796

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide?
The IUPAC name of N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide (CID 137013664) is N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide.
What is the SMILES notation for N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide?
The canonical SMILES for N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide is Cc1cc(/C(N)=N/O)cc(-n2cccn2)n1.
What is the InChIKey of N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide?
The InChIKey is MHEIYXAGVCWQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c1-7-5-8(10(11)14-16)6-9(13-7)15-4-2-3-12-15/h2-6,16H,1H3,(H2,11,14).
What are the key properties of N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide?
N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide has a molecular weight of 217.23 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-methyl-6-pyrazol-1-ylpyridine-4-carboximidamide is sourced from PubChem (CID 137013664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).