3-methyl-2H-indazole-5-carboximidamide

C9H10N4 — CID 83446802

IUPAC3-methyl-2H-indazole-5-carboximidamide
SMILES[H]/N=C(\N)c1ccc2n[nH]c(C)c2c1
InChIInChI=1S/C9H10N4/c1-5-7-4-6(9(10)11)2-3-8(7)13-12-5/h2-4H,1H3,(H3,10,11)(H,12,13)
InChIKeyNGGKSWWCDSXFQW-UHFFFAOYSA-N
MW174.21 g/mol
LogP1.16
Rot. Bonds1

About 3-methyl-2H-indazole-5-carboximidamide

3-methyl-2H-indazole-5-carboximidamide (PubChem CID 83446802) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 3-methyl-2H-indazole-5-carboximidamide.

Molecular Properties

Compound Name3-methyl-2H-indazole-5-carboximidamide
PubChem CID83446802
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name3-methyl-2H-indazole-5-carboximidamide
SMILES[H]/N=C(\N)c1ccc2n[nH]c(C)c2c1
InChIInChI=1S/C9H10N4/c1-5-7-4-6(9(10)11)2-3-8(7)13-12-5/h2-4H,1H3,(H3,10,11)(H,12,13)
InChIKeyNGGKSWWCDSXFQW-UHFFFAOYSA-N
XLogP1.16
TPSA78.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-3-methyl-2H-indazole-5-carboxamide
CID 58243589
2,1,3-benzoxadiazole-5-carboximidamide
CID 140791723
2-[(E)-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)ethenyl]-3H-benzimidazole-5-carboximidamide;tetrahydrochloride
CID 6918212
2-(5-methylpyrazin-2-yl)-3H-benzimidazole-5-carboximidamide
CID 22125515
2-[(6-methyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide
CID 54496754
4-diazenyl-3-methyl-N-(3-methyl-2H-indazol-5-yl)benzamide
CID 164961032
4-[(Z)-2-(4-carbamimidoylphenyl)ethenyl]-3-methylbenzenecarboximidamide;dihydrochloride
CID 24846159
3,4-dimethylbenzenecarboximidamide;ethanamine
CID 142030148
3,5-difluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]benzenecarboximidamide
CID 81342133
methyl 3-methyl-2H-indazole-6-carboxylate
CID 22387979
3-(diethylamino)-4-methylbenzenecarboximidamide
CID 173214309
2-[5-(6-carbamimidoyl-1H-benzimidazol-2-yl)-1H-pyrrol-2-yl]-3H-benzimidazole-5-carboximidamide;ethanol
CID 139912797

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2H-indazole-5-carboximidamide?
The IUPAC name of 3-methyl-2H-indazole-5-carboximidamide (CID 83446802) is 3-methyl-2H-indazole-5-carboximidamide.
What is the SMILES notation for 3-methyl-2H-indazole-5-carboximidamide?
The canonical SMILES for 3-methyl-2H-indazole-5-carboximidamide is [H]/N=C(\N)c1ccc2n[nH]c(C)c2c1.
What is the InChIKey of 3-methyl-2H-indazole-5-carboximidamide?
The InChIKey is NGGKSWWCDSXFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-5-7-4-6(9(10)11)2-3-8(7)13-12-5/h2-4H,1H3,(H3,10,11)(H,12,13).
What are the key properties of 3-methyl-2H-indazole-5-carboximidamide?
3-methyl-2H-indazole-5-carboximidamide has a molecular weight of 174.21 g/mol, XLogP of 1.16, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2H-indazole-5-carboximidamide is sourced from PubChem (CID 83446802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).