methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate

C15H14N2O4 — CID 63849862

IUPACmethyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate
SMILESCOC(=O)c1cc(C)ccc1NC(=O)c1cncc(O)c1
InChIInChI=1S/C15H14N2O4/c1-9-3-4-13(12(5-9)15(20)21-2)17-14(19)10-6-11(18)8-16-7-10/h3-8,18H,1-2H3,(H,17,19)
InChIKeyVREHDOLDXYPYQB-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.13
Rot. Bonds3

About methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate

methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate (PubChem CID 63849862) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate.

Molecular Properties

Compound Namemethyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate
PubChem CID63849862
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Namemethyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate
SMILESCOC(=O)c1cc(C)ccc1NC(=O)c1cncc(O)c1
InChIInChI=1S/C15H14N2O4/c1-9-3-4-13(12(5-9)15(20)21-2)17-14(19)10-6-11(18)8-16-7-10/h3-8,18H,1-2H3,(H,17,19)
InChIKeyVREHDOLDXYPYQB-UHFFFAOYSA-N
XLogP2.13
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[(5-hydroxypyridine-3-carbonyl)amino]-3-methylbenzoate
CID 63859252
methyl 5-methyl-2-[(5-methylfuran-3-carbonyl)amino]benzoate
CID 114822092
5-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 63860127
methyl 2-[(3-chloropyridine-4-carbonyl)amino]-5-methylbenzoate
CID 66484487
2-[(5-aminopyridine-3-carbonyl)amino]-5-methylbenzoic acid
CID 110488447
methyl 2-[[5-[(2,4-dimethylphenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109242696
methyl 5-methyl-2-[(4-methyl-1,3-oxazole-5-carbonyl)amino]benzoate
CID 79479514
methyl 2-[(5-bromothiophene-3-carbonyl)amino]-5-methylbenzoate
CID 43623715
5-hydroxy-N-(3-methylphenyl)pyridine-3-carboxamide
CID 63865627
5-hydroxy-N-[2-methyl-4-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 63860452
N-(6-bromo-2-methyl-3-pyridinyl)-5-hydroxypyridine-3-carboxamide
CID 113349996
methyl 5-methyl-2-(prop-2-enoylamino)benzoate
CID 43623759

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate?
The IUPAC name of methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate (CID 63849862) is methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate.
What is the SMILES notation for methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate?
The canonical SMILES for methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate is COC(=O)c1cc(C)ccc1NC(=O)c1cncc(O)c1.
What is the InChIKey of methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate?
The InChIKey is VREHDOLDXYPYQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-9-3-4-13(12(5-9)15(20)21-2)17-14(19)10-6-11(18)8-16-7-10/h3-8,18H,1-2H3,(H,17,19).
What are the key properties of methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate?
methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate has a molecular weight of 286.29 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(5-hydroxypyridine-3-carbonyl)amino]-5-methylbenzoate is sourced from PubChem (CID 63849862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).