benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate

C16H16N2O4 — CID 51177215

IUPACbenzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate
SMILESO=C(Cn1ccccc1=O)NCC(=O)OCc1ccccc1
InChIInChI=1S/C16H16N2O4/c19-14(11-18-9-5-4-8-15(18)20)17-10-16(21)22-12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,17,19)
InChIKeyYUUQTRKRTPVSLT-UHFFFAOYSA-N
MW300.31 g/mol
LogP0.71
Rot. Bonds6

About benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate

benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate (PubChem CID 51177215) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate.

Molecular Properties

Compound Namebenzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate
PubChem CID51177215
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC Namebenzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate
SMILESO=C(Cn1ccccc1=O)NCC(=O)OCc1ccccc1
InChIInChI=1S/C16H16N2O4/c19-14(11-18-9-5-4-8-15(18)20)17-10-16(21)22-12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,17,19)
InChIKeyYUUQTRKRTPVSLT-UHFFFAOYSA-N
XLogP0.71
TPSA77.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

benzyl 2-[(2-phenylacetyl)amino]acetate
CID 2168453
2-[[4-oxo-4-[(2-oxo-2-phenylmethoxyethyl)amino]butanoyl]amino]acetic acid
CID 139916418
benzyl 2-(3,3-dimethylbutanoylamino)acetate
CID 78799807
benzyl 2-[[2-(3,6-dimethyl-2-oxopiperazin-1-yl)acetyl]amino]acetate
CID 91343931
benzyl 2-[(2-tert-butylsulfanylacetyl)amino]acetate
CID 78786053
(4-phenylphenyl)methyl 2-[(2-phenylacetyl)amino]acetate
CID 7826713
2-[(3-oxo-3-phenylmethoxypropanoyl)amino]acetic acid
CID 69081504
benzyl 2-[(2-propylsulfanylacetyl)amino]acetate
CID 52671611
N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 51175658
benzyl 2-[(2-pyrazol-1-ylbenzoyl)amino]acetate
CID 87002296
benzyl 2-[[2-(2-chlorophenyl)sulfanylacetyl]amino]acetate
CID 30287022
benzyl 2-[[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetyl]amino]acetate
CID 27711358

Frequently Asked Questions

What is the IUPAC name of benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate?
The IUPAC name of benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate (CID 51177215) is benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate.
What is the SMILES notation for benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate?
The canonical SMILES for benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate is O=C(Cn1ccccc1=O)NCC(=O)OCc1ccccc1.
What is the InChIKey of benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate?
The InChIKey is YUUQTRKRTPVSLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c19-14(11-18-9-5-4-8-15(18)20)17-10-16(21)22-12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,17,19).
What are the key properties of benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate?
benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate has a molecular weight of 300.31 g/mol, XLogP of 0.71, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl 2-[[2-(2-oxo-1-pyridinyl)acetyl]amino]acetate is sourced from PubChem (CID 51177215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).