2-amino-N'-methylquinoline-6-carboximidamide

C11H12N4 — CID 139555651

IUPAC2-amino-N'-methylquinoline-6-carboximidamide
SMILESC/N=C(\N)c1ccc2nc(N)ccc2c1
InChIInChI=1S/C11H12N4/c1-14-11(13)8-2-4-9-7(6-8)3-5-10(12)15-9/h2-6H,1H3,(H2,12,15)(H2,13,14)
InChIKeyUGESCIHXEQHTCA-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.15
Rot. Bonds1

About 2-amino-N'-methylquinoline-6-carboximidamide

2-amino-N'-methylquinoline-6-carboximidamide (PubChem CID 139555651) has the molecular formula C11H12N4 and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-amino-N'-methylquinoline-6-carboximidamide.

Molecular Properties

Compound Name2-amino-N'-methylquinoline-6-carboximidamide
PubChem CID139555651
Molecular FormulaC11H12N4
Molecular Weight200.24 g/mol
Exact Mass200.11
IUPAC Name2-amino-N'-methylquinoline-6-carboximidamide
SMILESC/N=C(\N)c1ccc2nc(N)ccc2c1
InChIInChI=1S/C11H12N4/c1-14-11(13)8-2-4-9-7(6-8)3-5-10(12)15-9/h2-6H,1H3,(H2,12,15)(H2,13,14)
InChIKeyUGESCIHXEQHTCA-UHFFFAOYSA-N
XLogP1.15
TPSA77.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.15
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N'-methylquinoline-6-carboximidamide?
The IUPAC name of 2-amino-N'-methylquinoline-6-carboximidamide (CID 139555651) is 2-amino-N'-methylquinoline-6-carboximidamide.
What is the SMILES notation for 2-amino-N'-methylquinoline-6-carboximidamide?
The canonical SMILES for 2-amino-N'-methylquinoline-6-carboximidamide is C/N=C(\N)c1ccc2nc(N)ccc2c1.
What is the InChIKey of 2-amino-N'-methylquinoline-6-carboximidamide?
The InChIKey is UGESCIHXEQHTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c1-14-11(13)8-2-4-9-7(6-8)3-5-10(12)15-9/h2-6H,1H3,(H2,12,15)(H2,13,14).
What are the key properties of 2-amino-N'-methylquinoline-6-carboximidamide?
2-amino-N'-methylquinoline-6-carboximidamide has a molecular weight of 200.24 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N'-methylquinoline-6-carboximidamide is sourced from PubChem (CID 139555651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).