2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C14H16N4O3 — CID 113163941

IUPAC2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(C)on1)Cc1ccncc1
InChIInChI=1S/C14H16N4O3/c1-10-7-13(17-21-10)16-14(20)9-18(11(2)19)8-12-3-5-15-6-4-12/h3-7H,8-9H2,1-2H3,(H,16,17,20)
InChIKeyMJFPHYWVWUZLSG-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.37
Rot. Bonds5

About 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 113163941) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID113163941
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(C)on1)Cc1ccncc1
InChIInChI=1S/C14H16N4O3/c1-10-7-13(17-21-10)16-14(20)9-18(11(2)19)8-12-3-5-15-6-4-12/h3-7H,8-9H2,1-2H3,(H,16,17,20)
InChIKeyMJFPHYWVWUZLSG-UHFFFAOYSA-N
XLogP1.37
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-4-ylacetamide
CID 110697404
2-[acetyl(2-methylpropyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 813520
2-(N-acetyl-2,6-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 113168816
3-[acetyl-[(3-methylphenyl)methyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113118715
2-[dimethylcarbamoyl(ethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 814446
2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2438629
2,2-dichloro-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-prop-2-enylacetamide
CID 42770232
4-(diethylaminomethyl)-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzamide
CID 46477484
2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanyl-N-pyridin-4-ylacetamide
CID 32921547
2-[acetyl(pyridin-4-ylmethyl)amino]-N-[(4-chlorophenyl)methyl]acetamide
CID 113163778
2-(N,4-diacetylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 113175717
2-[carboxymethyl-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]acetic acid
CID 55245946

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 113163941) is 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is CC(=O)N(CC(=O)Nc1cc(C)on1)Cc1ccncc1.
What is the InChIKey of 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is MJFPHYWVWUZLSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-10-7-13(17-21-10)16-14(20)9-18(11(2)19)8-12-3-5-15-6-4-12/h3-7H,8-9H2,1-2H3,(H,16,17,20).
What are the key properties of 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 288.31 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(pyridin-4-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 113163941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).