N-amino-N',2-dimethylpyrazole-3-carboximidamide

C6H11N5 — CID 62918941

IUPACN-amino-N',2-dimethylpyrazole-3-carboximidamide
SMILESC/N=C(\NN)c1ccnn1C
InChIInChI=1S/C6H11N5/c1-8-6(10-7)5-3-4-9-11(5)2/h3-4H,7H2,1-2H3,(H,8,10)
InChIKeyJZZABAOGOADNOS-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.74
Rot. Bonds1

About N-amino-N',2-dimethylpyrazole-3-carboximidamide

N-amino-N',2-dimethylpyrazole-3-carboximidamide (PubChem CID 62918941) has the molecular formula C6H11N5 and a molecular weight of 153.19 g/mol. Its IUPAC name is N-amino-N',2-dimethylpyrazole-3-carboximidamide.

Molecular Properties

Compound NameN-amino-N',2-dimethylpyrazole-3-carboximidamide
PubChem CID62918941
Molecular FormulaC6H11N5
Molecular Weight153.19 g/mol
Exact Mass153.10
IUPAC NameN-amino-N',2-dimethylpyrazole-3-carboximidamide
SMILESC/N=C(\NN)c1ccnn1C
InChIInChI=1S/C6H11N5/c1-8-6(10-7)5-3-4-9-11(5)2/h3-4H,7H2,1-2H3,(H,8,10)
InChIKeyJZZABAOGOADNOS-UHFFFAOYSA-N
XLogP-0.74
TPSA68.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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-amino-N',2-dimethylpyrazole-3-carboximidamide?
The IUPAC name of N-amino-N',2-dimethylpyrazole-3-carboximidamide (CID 62918941) is N-amino-N',2-dimethylpyrazole-3-carboximidamide.
What is the SMILES notation for N-amino-N',2-dimethylpyrazole-3-carboximidamide?
The canonical SMILES for N-amino-N',2-dimethylpyrazole-3-carboximidamide is C/N=C(\NN)c1ccnn1C.
What is the InChIKey of N-amino-N',2-dimethylpyrazole-3-carboximidamide?
The InChIKey is JZZABAOGOADNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5/c1-8-6(10-7)5-3-4-9-11(5)2/h3-4H,7H2,1-2H3,(H,8,10).
What are the key properties of N-amino-N',2-dimethylpyrazole-3-carboximidamide?
N-amino-N',2-dimethylpyrazole-3-carboximidamide has a molecular weight of 153.19 g/mol, XLogP of -0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N',2-dimethylpyrazole-3-carboximidamide is sourced from PubChem (CID 62918941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).