N'-aminoquinoline-2-carboximidamide

C10H10N4 — CID 14642973

IUPACN'-aminoquinoline-2-carboximidamide
SMILESN/N=C(\N)c1ccc2ccccc2n1
InChIInChI=1S/C10H10N4/c11-10(14-12)9-6-5-7-3-1-2-4-8(7)13-9/h1-6H,12H2,(H2,11,14)
InChIKeyWNIZZMOQFRUDCK-UHFFFAOYSA-N
MW186.22 g/mol
LogP0.81
Rot. Bonds1

About N'-aminoquinoline-2-carboximidamide

N'-aminoquinoline-2-carboximidamide (PubChem CID 14642973) has the molecular formula C10H10N4 and a molecular weight of 186.22 g/mol. Its IUPAC name is N'-aminoquinoline-2-carboximidamide.

Molecular Properties

Compound NameN'-aminoquinoline-2-carboximidamide
PubChem CID14642973
Molecular FormulaC10H10N4
Molecular Weight186.22 g/mol
Exact Mass186.09
IUPAC NameN'-aminoquinoline-2-carboximidamide
SMILESN/N=C(\N)c1ccc2ccccc2n1
InChIInChI=1S/C10H10N4/c11-10(14-12)9-6-5-7-3-1-2-4-8(7)13-9/h1-6H,12H2,(H2,11,14)
InChIKeyWNIZZMOQFRUDCK-UHFFFAOYSA-N
XLogP0.81
TPSA77.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.22
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'-aminoquinoline-2-carboximidamide?
The IUPAC name of N'-aminoquinoline-2-carboximidamide (CID 14642973) is N'-aminoquinoline-2-carboximidamide.
What is the SMILES notation for N'-aminoquinoline-2-carboximidamide?
The canonical SMILES for N'-aminoquinoline-2-carboximidamide is N/N=C(\N)c1ccc2ccccc2n1.
What is the InChIKey of N'-aminoquinoline-2-carboximidamide?
The InChIKey is WNIZZMOQFRUDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4/c11-10(14-12)9-6-5-7-3-1-2-4-8(7)13-9/h1-6H,12H2,(H2,11,14).
What are the key properties of N'-aminoquinoline-2-carboximidamide?
N'-aminoquinoline-2-carboximidamide has a molecular weight of 186.22 g/mol, XLogP of 0.81, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-aminoquinoline-2-carboximidamide is sourced from PubChem (CID 14642973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).