N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide

C19H18N4O — CID 149084238

IUPACN-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cc(C)nc(-c3cnccc3C)c2)ccn1
InChIInChI=1S/C19H18N4O/c1-12-4-6-20-11-17(12)18-9-16(8-13(2)22-18)15-5-7-21-19(10-15)23-14(3)24/h4-11H,1-3H3,(H,21,23,24)
InChIKeyQQXYAZKYGBFCBS-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.78
Rot. Bonds3

About N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide

N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide (PubChem CID 149084238) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide
PubChem CID149084238
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC NameN-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cc(C)nc(-c3cnccc3C)c2)ccn1
InChIInChI=1S/C19H18N4O/c1-12-4-6-20-11-17(12)18-9-16(8-13(2)22-18)15-5-7-21-19(10-15)23-14(3)24/h4-11H,1-3H3,(H,21,23,24)
InChIKeyQQXYAZKYGBFCBS-UHFFFAOYSA-N
XLogP3.78
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide 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-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide (CID 149084238) is N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide is CC(=O)Nc1cc(-c2cc(C)nc(-c3cnccc3C)c2)ccn1.
What is the InChIKey of N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide?
The InChIKey is QQXYAZKYGBFCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-12-4-6-20-11-17(12)18-9-16(8-13(2)22-18)15-5-7-21-19(10-15)23-14(3)24/h4-11H,1-3H3,(H,21,23,24).
What are the key properties of N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide?
N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide has a molecular weight of 318.38 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-methyl-6-(4-methyl-3-pyridinyl)-4-pyridinyl]-2-pyridinyl]acetamide is sourced from PubChem (CID 149084238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).