6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide

C10H15N5 — CID 134410100

IUPAC6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide
SMILES[H]/N=C(/c1cccc(N)n1)N(/C=N/[H])C(C)C
InChIInChI=1S/C10H15N5/c1-7(2)15(6-11)10(13)8-4-3-5-9(12)14-8/h3-7,11,13H,1-2H3,(H2,12,14)/b11-6+,13-10-
InChIKeyXVADOSRQGWMQTH-OIUPSWSQSA-N
MW205.27 g/mol
LogP1.31
Rot. Bonds3

About 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide

6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide (PubChem CID 134410100) has the molecular formula C10H15N5 and a molecular weight of 205.27 g/mol. Its IUPAC name is 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide.

Molecular Properties

Compound Name6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide
PubChem CID134410100
Molecular FormulaC10H15N5
Molecular Weight205.27 g/mol
Exact Mass205.13
IUPAC Name6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide
SMILES[H]/N=C(/c1cccc(N)n1)N(/C=N/[H])C(C)C
InChIInChI=1S/C10H15N5/c1-7(2)15(6-11)10(13)8-4-3-5-9(12)14-8/h3-7,11,13H,1-2H3,(H2,12,14)/b11-6+,13-10-
InChIKeyXVADOSRQGWMQTH-OIUPSWSQSA-N
XLogP1.31
TPSA89.85 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide?
The IUPAC name of 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide (CID 134410100) is 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide.
What is the SMILES notation for 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide?
The canonical SMILES for 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide is [H]/N=C(/c1cccc(N)n1)N(/C=N/[H])C(C)C.
What is the InChIKey of 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide?
The InChIKey is XVADOSRQGWMQTH-OIUPSWSQSA-N. The full InChI is InChI=1S/C10H15N5/c1-7(2)15(6-11)10(13)8-4-3-5-9(12)14-8/h3-7,11,13H,1-2H3,(H2,12,14)/b11-6+,13-10-.
What are the key properties of 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide?
6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide has a molecular weight of 205.27 g/mol, XLogP of 1.31, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-methanimidoyl-N-propan-2-ylpyridine-2-carboximidamide is sourced from PubChem (CID 134410100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).