4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide

C15H16N4O2 — CID 107337787

IUPAC4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide
SMILESCc1cc(C(N)=O)ccc1NC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C15H16N4O2/c1-9-6-10(15(17)21)2-5-13(9)19-14(20)7-12-4-3-11(16)8-18-12/h2-6,8H,7,16H2,1H3,(H2,17,21)(H,19,20)
InChIKeyWYKJPSQXGQGLGB-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.25
Rot. Bonds4

About 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide

4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide (PubChem CID 107337787) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide.

Molecular Properties

Compound Name4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide
PubChem CID107337787
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide
SMILESCc1cc(C(N)=O)ccc1NC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C15H16N4O2/c1-9-6-10(15(17)21)2-5-13(9)19-14(20)7-12-4-3-11(16)8-18-12/h2-6,8H,7,16H2,1H3,(H2,17,21)(H,19,20)
InChIKeyWYKJPSQXGQGLGB-UHFFFAOYSA-N
XLogP1.25
TPSA111.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-(5-amino-2-pyridinyl)acetyl]amino]-4-fluorobenzamide
CID 107337783
4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-methylbenzamide
CID 62798358
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-chlorobenzoic acid
CID 107338917
2-(5-amino-2-pyridinyl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 107337459
2-(5-amino-2-pyridinyl)-N-(2,6-dimethylphenyl)acetamide
CID 107337469
2-(5-amino-2-pyridinyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 107337386
3-methyl-4-(3-oxobutanoylamino)benzamide
CID 61251334
4-[(5-hydroxy-2-pyridinyl)methylamino]-3-methylbenzamide
CID 79776352
2-(5-amino-2-pyridinyl)-N-(2-hydroxyphenyl)acetamide
CID 107338919
2-(5-amino-2-pyridinyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 107339612
2-(5-amino-2-pyridinyl)-N-[2,4-di(propan-2-yl)phenyl]acetamide;hydrochloride
CID 120622112
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]benzoic acid
CID 107338179

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide?
The IUPAC name of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide (CID 107337787) is 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide.
What is the SMILES notation for 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide?
The canonical SMILES for 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide is Cc1cc(C(N)=O)ccc1NC(=O)Cc1ccc(N)cn1.
What is the InChIKey of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide?
The InChIKey is WYKJPSQXGQGLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-9-6-10(15(17)21)2-5-13(9)19-14(20)7-12-4-3-11(16)8-18-12/h2-6,8H,7,16H2,1H3,(H2,17,21)(H,19,20).
What are the key properties of 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide?
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide has a molecular weight of 284.32 g/mol, XLogP of 1.25, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbenzamide is sourced from PubChem (CID 107337787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).