2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide

C13H21N3O2 — CID 54956647

IUPAC2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNc1ccc(OC)nc1
InChIInChI=1S/C13H21N3O2/c1-5-13(2,3)16-11(17)9-14-10-6-7-12(18-4)15-8-10/h6-8,14H,5,9H2,1-4H3,(H,16,17)
InChIKeyLXXSDPPNGMAJSA-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.81
Rot. Bonds6

About 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide

2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide (PubChem CID 54956647) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide
PubChem CID54956647
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNc1ccc(OC)nc1
InChIInChI=1S/C13H21N3O2/c1-5-13(2,3)16-11(17)9-14-10-6-7-12(18-4)15-8-10/h6-8,14H,5,9H2,1-4H3,(H,16,17)
InChIKeyLXXSDPPNGMAJSA-UHFFFAOYSA-N
XLogP1.81
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide 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

2-[(6-methoxy-3-pyridinyl)amino]-N-pentan-3-ylacetamide
CID 54957106
N-butan-2-yl-2-[(6-methoxy-3-pyridinyl)amino]acetamide
CID 43199045
2-(4-fluoroanilino)-N-(2-methylbutan-2-yl)acetamide
CID 60671142
N-tert-butyl-2-[(6-methoxy-3-pyridinyl)carbamoylamino]acetamide
CID 47139507
2-[(6-methoxy-3-pyridinyl)amino]-2-methylbutanoic acid
CID 114987513
N-(2-bromoprop-2-enyl)-6-methoxypyridin-3-amine
CID 60873566
2-[(6-methoxy-3-pyridinyl)amino]-2-methylpentanoic acid
CID 114990583
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
2-amino-N-(6-methoxy-3-pyridinyl)-2-methylpropanamide
CID 61266355
2-(3-fluoro-4-methylanilino)-N-(2-methylbutan-2-yl)acetamide
CID 60672268
ethyl 2-[(6-methoxy-3-pyridinyl)carbamoylamino]acetate
CID 43385059
N-(6-methoxy-3-pyridinyl)-2-methyl-2-(methylamino)propanamide
CID 62834491

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide (CID 54956647) is 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNc1ccc(OC)nc1.
What is the InChIKey of 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is LXXSDPPNGMAJSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-5-13(2,3)16-11(17)9-14-10-6-7-12(18-4)15-8-10/h6-8,14H,5,9H2,1-4H3,(H,16,17).
What are the key properties of 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide?
2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 251.33 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methoxy-3-pyridinyl)amino]-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 54956647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).