methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate

C15H14N2O4 — CID 62109864

IUPACmethyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate
SMILESCOC(=O)C(NC(=O)c1ncccc1O)c1ccccc1
InChIInChI=1S/C15H14N2O4/c1-21-15(20)12(10-6-3-2-4-7-10)17-14(19)13-11(18)8-5-9-16-13/h2-9,12,18H,1H3,(H,17,19)
InChIKeyTWWRJZPLUPKCPR-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.43
Rot. Bonds4

About methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate

methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate (PubChem CID 62109864) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate.

Molecular Properties

Compound Namemethyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate
PubChem CID62109864
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Namemethyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate
SMILESCOC(=O)C(NC(=O)c1ncccc1O)c1ccccc1
InChIInChI=1S/C15H14N2O4/c1-21-15(20)12(10-6-3-2-4-7-10)17-14(19)13-11(18)8-5-9-16-13/h2-9,12,18H,1H3,(H,17,19)
InChIKeyTWWRJZPLUPKCPR-UHFFFAOYSA-N
XLogP1.43
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[(3-aminopyridine-2-carbonyl)amino]-2-phenylacetate
CID 104742175
methyl (2R)-2-[[2-[[(1R)-2-methoxy-2-oxo-1-phenylethyl]carbamoyl]benzoyl]amino]-2-phenylacetate
CID 26791246
methyl (2S)-2-[[2-(2-methoxyethoxy)pyridine-3-carbonyl]amino]-2-phenylacetate
CID 94817951
methyl 2-[(2-aminobenzoyl)amino]-2-phenylacetate
CID 62109453
methyl (2S)-2-phenyl-2-(pyrimidin-2-ylamino)acetate
CID 94357367
(2S)-2-[(3-hydroxypyridine-2-carbonyl)amino]propanoic acid
CID 59513093
methyl 2-phenyl-2-(pyrazine-2-carbonylamino)acetate
CID 12580941
methyl (2R)-2-acetamido-2-phenylacetate
CID 10921683
(2S)-2-[(3-hydroxypyridine-2-carbonyl)amino]-4-methoxy-4-oxobutanoic acid
CID 63303459
methyl 2-[(2-methylpyridine-4-carbonyl)amino]-2-phenylacetate
CID 106753818
methyl (2S)-2-phenyl-2-(pyridin-2-ylamino)acetate
CID 102268915
methyl (2R)-2-phenyl-2-[[4-(2-phenylethynyl)benzoyl]amino]acetate
CID 71580592

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate?
The IUPAC name of methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate (CID 62109864) is methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate.
What is the SMILES notation for methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate?
The canonical SMILES for methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate is COC(=O)C(NC(=O)c1ncccc1O)c1ccccc1.
What is the InChIKey of methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate?
The InChIKey is TWWRJZPLUPKCPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-21-15(20)12(10-6-3-2-4-7-10)17-14(19)13-11(18)8-5-9-16-13/h2-9,12,18H,1H3,(H,17,19).
What are the key properties of methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate?
methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate has a molecular weight of 286.29 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(3-hydroxypyridine-2-carbonyl)amino]-2-phenylacetate is sourced from PubChem (CID 62109864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).