6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid

C15H14N2O4 — CID 15239997

IUPAC6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid
SMILESCC(=O)Nc1ccc(OCc2ccccc2)c(C(=O)O)n1
InChIInChI=1S/C15H14N2O4/c1-10(18)16-13-8-7-12(14(17-13)15(19)20)21-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,19,20)(H,16,17,18)
InChIKeyCKEGVSOCXYGYAU-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.32
Rot. Bonds5

About 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid

6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid (PubChem CID 15239997) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid
PubChem CID15239997
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid
SMILESCC(=O)Nc1ccc(OCc2ccccc2)c(C(=O)O)n1
InChIInChI=1S/C15H14N2O4/c1-10(18)16-13-8-7-12(14(17-13)15(19)20)21-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,19,20)(H,16,17,18)
InChIKeyCKEGVSOCXYGYAU-UHFFFAOYSA-N
XLogP2.32
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-formyl-5-phenylmethoxy-2-pyridinyl)acetamide
CID 15239996
methyl 6-methyl-3-phenylmethoxypyridine-2-carboxylate
CID 145241727
6-methyl-3-(phenylmethoxymethoxy)pyridine-2-carboxylic acid
CID 102939706
N-[2-[(5-chloro-2-phenylmethoxyphenyl)methyl]-1,3-thiazol-4-yl]acetamide
CID 59786385
ethane;6-phenylmethoxypyridine-2,3-dicarboxylic acid
CID 91075341
N-(4-phenylmethoxy-3-propylphenyl)acetamide
CID 57080743
3,4-bis(phenylmethoxy)pyridine-2,6-dicarboxylic acid
CID 54512111
5,6-bis(phenylmethoxy)pyridine-2-carboxylic acid
CID 166479827
N-(4-methyl-2-phenylmethoxyphenyl)acetamide
CID 47311961
N-[6-[5-[6-(6-acetamido-2-pyridinyl)-2-(methoxymethoxy)-7-phenylmethoxynaphthalen-1-yl]-6-(methoxymethoxy)-3-phenylmethoxynaphthalen-2-yl]-2-pyridinyl]acetamide
CID 10557530
methyl 2-[6-(hydroxymethyl)-3-phenylmethoxy-2-pyridinyl]prop-2-enoate
CID 86751043
6-bromo-N-methyl-5-phenylmethoxypyridin-2-amine
CID 167449160

Frequently Asked Questions

What is the IUPAC name of 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid?
The IUPAC name of 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid (CID 15239997) is 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid.
What is the SMILES notation for 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid?
The canonical SMILES for 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid is CC(=O)Nc1ccc(OCc2ccccc2)c(C(=O)O)n1.
What is the InChIKey of 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid?
The InChIKey is CKEGVSOCXYGYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-10(18)16-13-8-7-12(14(17-13)15(19)20)21-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,19,20)(H,16,17,18).
What are the key properties of 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid?
6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetamido-3-phenylmethoxypyridine-2-carboxylic acid is sourced from PubChem (CID 15239997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).