3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate

C19H30N2O8 — CID 142237813

IUPAC3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate
SMILESCOC(=O)C1CCCC1.COCCC(=O)OC.COc1ccnc(C(N)=O)c1O
InChIInChI=1S/C7H8N2O3.C7H12O2.C5H10O3/c1-12-4-2-3-9-5(6(4)10)7(8)11;1-9-7(8)6-4-2-3-5-6;1-7-4-3-5(6)8-2/h2-3,10H,1H3,(H2,8,11);6H,2-5H2,1H3;3-4H2,1-2H3
InChIKeyUJWRCOOVYXFGDR-UHFFFAOYSA-N
MW414.46 g/mol
LogP1.44
Rot. Bonds6

About 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate

3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate (PubChem CID 142237813) has the molecular formula C19H30N2O8 and a molecular weight of 414.46 g/mol. Its IUPAC name is 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate.

Molecular Properties

Compound Name3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate
PubChem CID142237813
Molecular FormulaC19H30N2O8
Molecular Weight414.46 g/mol
Exact Mass414.20
IUPAC Name3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate
SMILESCOC(=O)C1CCCC1.COCCC(=O)OC.COc1ccnc(C(N)=O)c1O
InChIInChI=1S/C7H8N2O3.C7H12O2.C5H10O3/c1-12-4-2-3-9-5(6(4)10)7(8)11;1-9-7(8)6-4-2-3-5-6;1-7-4-3-5(6)8-2/h2-3,10H,1H3,(H2,8,11);6H,2-5H2,1H3;3-4H2,1-2H3
InChIKeyUJWRCOOVYXFGDR-UHFFFAOYSA-N
XLogP1.44
TPSA147.27 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.46
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

(2-carbamoyl-4-methoxy-3-pyridinyl)oxymethyl butanoate;ethane;methyl 3-methoxypropanoate
CID 142237797
N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088897
N-cyclobutyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088893
3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
CID 142553714
1-cyclohexylpropyl (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 165176388
[8-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]-2-methyl-4-(3-methylbutyl)-9-oxooxonan-3-yl] cyclopentanecarboxylate
CID 123604198
butane;3-hydroxy-4-methoxypyridine-2-carboxamide;1-phenylpropan-2-yl propanoate
CID 145115424
3-hydroxy-4-methoxy-N-[(3S)-9-methyl-2-oxo-1,5-dioxonan-3-yl]pyridine-2-carboxamide;methyl 3-hydroxypropanoate
CID 145346574
4-(cyclopropylmethoxy)butan-2-yl propanoate;3-hydroxy-4-methoxypyridine-2-carboxamide;1-methoxy-4-methylbenzene
CID 145115167
3-hydroxy-4-methoxy-N-(2-phenylethyl)pyridine-2-carboxamide
CID 21088902
3-hydroxy-4-methoxy-N-(1-oxopropan-2-yl)pyridine-2-carboxamide
CID 138538614
3-hydroxy-4-methoxy-N-[(2S)-3-oxobutan-2-yl]pyridine-2-carboxamide
CID 163574923

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate?
The IUPAC name of 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate (CID 142237813) is 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate.
What is the SMILES notation for 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate?
The canonical SMILES for 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate is COC(=O)C1CCCC1.COCCC(=O)OC.COc1ccnc(C(N)=O)c1O.
What is the InChIKey of 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate?
The InChIKey is UJWRCOOVYXFGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3.C7H12O2.C5H10O3/c1-12-4-2-3-9-5(6(4)10)7(8)11;1-9-7(8)6-4-2-3-5-6;1-7-4-3-5(6)8-2/h2-3,10H,1H3,(H2,8,11);6H,2-5H2,1H3;3-4H2,1-2H3.
What are the key properties of 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate?
3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate has a molecular weight of 414.46 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methoxypyridine-2-carboxamide;methyl cyclopentanecarboxylate;methyl 3-methoxypropanoate is sourced from PubChem (CID 142237813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).