2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid

C16H16N2O3 — CID 107338478

IUPAC2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid
SMILESCc1ccccc1CC(=O)Nc1ccc(CC(=O)O)nc1
InChIInChI=1S/C16H16N2O3/c1-11-4-2-3-5-12(11)8-15(19)18-14-7-6-13(17-10-14)9-16(20)21/h2-7,10H,8-9H2,1H3,(H,18,19)(H,20,21)
InChIKeyJLZXMFHSERWQEW-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.20
Rot. Bonds5

About 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid

2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid (PubChem CID 107338478) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid.

Molecular Properties

Compound Name2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid
PubChem CID107338478
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid
SMILESCc1ccccc1CC(=O)Nc1ccc(CC(=O)O)nc1
InChIInChI=1S/C16H16N2O3/c1-11-4-2-3-5-12(11)8-15(19)18-14-7-6-13(17-10-14)9-16(20)21/h2-7,10H,8-9H2,1H3,(H,18,19)(H,20,21)
InChIKeyJLZXMFHSERWQEW-UHFFFAOYSA-N
XLogP2.20
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-[[2-(4-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107338384
2-[5-[[2-(4-bromophenyl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107338937
N-[6-(tert-butylamino)-3-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113014815
2-[5-[(2-pyridin-3-ylacetyl)amino]-2-pyridinyl]acetic acid
CID 107339387
2-[5-[[2-(4-aminophenyl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107340926
N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide
CID 56784483
2-[5-(carbamoylamino)-2-pyridinyl]acetic acid
CID 107339512
2-[5-(ethoxycarbonylamino)-2-pyridinyl]acetic acid
CID 107339556
2-[5-(2-aminopropanoylamino)-2-pyridinyl]acetic acid
CID 107341028
2-[5-[[(2R)-2-amino-2-phenylacetyl]amino]-2-pyridinyl]acetic acid
CID 107341049
2-[5-[[methyl(phenyl)carbamoyl]amino]-2-pyridinyl]acetic acid
CID 107340396
2-[5-[[2-(2-methoxyethylamino)acetyl]amino]-2-pyridinyl]acetic acid
CID 107340978

Frequently Asked Questions

What is the IUPAC name of 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid?
The IUPAC name of 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid (CID 107338478) is 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid.
What is the SMILES notation for 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid?
The canonical SMILES for 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid is Cc1ccccc1CC(=O)Nc1ccc(CC(=O)O)nc1.
What is the InChIKey of 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid?
The InChIKey is JLZXMFHSERWQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-11-4-2-3-5-12(11)8-15(19)18-14-7-6-13(17-10-14)9-16(20)21/h2-7,10H,8-9H2,1H3,(H,18,19)(H,20,21).
What are the key properties of 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid?
2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid has a molecular weight of 284.32 g/mol, XLogP of 2.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]acetic acid is sourced from PubChem (CID 107338478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).