6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide

C13H15N5 — CID 43563471

IUPAC6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N(C)Cc2cccnc2)nc1
InChIInChI=1S/C13H15N5/c1-18(9-10-3-2-6-16-7-10)12-5-4-11(8-17-12)13(14)15/h2-8H,9H2,1H3,(H3,14,15)
InChIKeyKAGGCRZNRUQFSI-UHFFFAOYSA-N
MW241.30 g/mol
LogP1.40
Rot. Bonds4

About 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide

6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide (PubChem CID 43563471) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide
PubChem CID43563471
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC Name6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N(C)Cc2cccnc2)nc1
InChIInChI=1S/C13H15N5/c1-18(9-10-3-2-6-16-7-10)12-5-4-11(8-17-12)13(14)15/h2-8H,9H2,1H3,(H3,14,15)
InChIKeyKAGGCRZNRUQFSI-UHFFFAOYSA-N
XLogP1.40
TPSA78.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 51.40
H-Bond Donors ≤ 52
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-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide with MolForge

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

Launch Full Analysis

Related Compounds

6-[methyl-[(4-methylphenyl)methyl]amino]pyridine-3-carboximidamide
CID 28799322
3-methyl-4-[methyl(pyridin-3-ylmethyl)amino]benzenecarboximidamide
CID 54933735
6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboximidamide
CID 54943583
3-[methyl(pyridin-3-ylmethyl)amino]pyrazine-2-carboximidamide
CID 62684033
2-[methyl(pyridin-3-ylmethyl)amino]pyrimidine-4-carboximidamide
CID 107550165
6-[cyclopropylmethyl(methyl)amino]pyridine-3-carboximidamide
CID 60985659
6-[cyclobutylmethyl(methyl)amino]pyridine-3-carboximidamide
CID 62860621
4-(pyridin-3-ylmethoxy)benzenecarboximidamide;dihydrochloride
CID 47002329
2-bromo-3-fluoro-4-[methyl(pyridin-3-ylmethyl)amino]benzenecarboximidamide
CID 107536326
6-[methyl(1-methylsulfanylbutan-2-yl)amino]pyridine-3-carboximidamide
CID 112660156
[6-[methyl(pyridin-3-ylmethyl)amino]-2-pyridinyl]methanol
CID 62254279
3-[[methyl(pyridin-4-yl)amino]methyl]benzenecarboximidamide
CID 62968427

Frequently Asked Questions

What is the IUPAC name of 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide?
The IUPAC name of 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide (CID 43563471) is 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide.
What is the SMILES notation for 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide?
The canonical SMILES for 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(N(C)Cc2cccnc2)nc1.
What is the InChIKey of 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide?
The InChIKey is KAGGCRZNRUQFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-18(9-10-3-2-6-16-7-10)12-5-4-11(8-17-12)13(14)15/h2-8H,9H2,1H3,(H3,14,15).
What are the key properties of 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide?
6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide has a molecular weight of 241.30 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carboximidamide is sourced from PubChem (CID 43563471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).