N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine

C19H16N6 — CID 130249629

IUPACN-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine
SMILESC/N=C/c1ccnc(-c2ccc3cnn(-c4cccc(C)n4)c3c2)n1
InChIInChI=1S/C19H16N6/c1-13-4-3-5-18(23-13)25-17-10-14(6-7-15(17)11-22-25)19-21-9-8-16(24-19)12-20-2/h3-12H,1-2H3/b20-12+
InChIKeyUCALCRXYFLJSPL-UDWIEESQSA-N
MW328.38 g/mol
LogP3.23
Rot. Bonds3

About N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine

N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine (PubChem CID 130249629) has the molecular formula C19H16N6 and a molecular weight of 328.38 g/mol. Its IUPAC name is N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine.

Molecular Properties

Compound NameN-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine
PubChem CID130249629
Molecular FormulaC19H16N6
Molecular Weight328.38 g/mol
Exact Mass328.14
IUPAC NameN-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine
SMILESC/N=C/c1ccnc(-c2ccc3cnn(-c4cccc(C)n4)c3c2)n1
InChIInChI=1S/C19H16N6/c1-13-4-3-5-18(23-13)25-17-10-14(6-7-15(17)11-22-25)19-21-9-8-16(24-19)12-20-2/h3-12H,1-2H3/b20-12+
InChIKeyUCALCRXYFLJSPL-UDWIEESQSA-N
XLogP3.23
TPSA68.85 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine 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 N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine?
The IUPAC name of N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine (CID 130249629) is N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine.
What is the SMILES notation for N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine?
The canonical SMILES for N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine is C/N=C/c1ccnc(-c2ccc3cnn(-c4cccc(C)n4)c3c2)n1.
What is the InChIKey of N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine?
The InChIKey is UCALCRXYFLJSPL-UDWIEESQSA-N. The full InChI is InChI=1S/C19H16N6/c1-13-4-3-5-18(23-13)25-17-10-14(6-7-15(17)11-22-25)19-21-9-8-16(24-19)12-20-2/h3-12H,1-2H3/b20-12+.
What are the key properties of N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine?
N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine has a molecular weight of 328.38 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidin-4-yl]methanimine is sourced from PubChem (CID 130249629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).