2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid

C14H14N2O2 — CID 54597167

IUPAC2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid
SMILESCN(c1ccc(CC(=O)O)cc1)c1ccccn1
InChIInChI=1S/C14H14N2O2/c1-16(13-4-2-3-9-15-13)12-7-5-11(6-8-12)10-14(17)18/h2-9H,10H2,1H3,(H,17,18)
InChIKeyJLPGJNGFKDXQGE-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.48
Rot. Bonds4

About 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid

2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid (PubChem CID 54597167) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid.

Molecular Properties

Compound Name2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid
PubChem CID54597167
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid
SMILESCN(c1ccc(CC(=O)O)cc1)c1ccccn1
InChIInChI=1S/C14H14N2O2/c1-16(13-4-2-3-9-15-13)12-7-5-11(6-8-12)10-14(17)18/h2-9H,10H2,1H3,(H,17,18)
InChIKeyJLPGJNGFKDXQGE-UHFFFAOYSA-N
XLogP2.48
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(4-methylphenyl)pyridin-2-amine
CID 89072599
N-(4-tert-butylphenyl)-N-methylpyridin-2-amine
CID 91397569
N-methyl-N-pyridin-2-ylpyridin-2-amine
CID 14365053
2-[methyl(pyridin-2-yl)amino]acetic acid;hydrochloride
CID 71627035
N,2-diphenyl-N-pyridin-2-ylacetamide
CID 24832254
2-[4-(pyridin-2-ylmethoxy)phenyl]acetic acid
CID 18958983
2-[4-[4-(dimethylamino)phenyl]phenyl]acetic acid
CID 39226143
2-[4-[acetyl(methyl)amino]phenyl]acetic acid
CID 20670865
[acetyloxymethyl(pyridin-2-yl)amino]methyl acetate
CID 143195366
2-[4-[(pyridin-2-ylmethylamino)methyl]phenyl]acetic acid
CID 103235916
2-(4-bromophenyl)-N-[6-(N-methylanilino)-3-pyridinyl]acetamide
CID 113016501
ethyl N-phenyl-N-pyridin-2-ylcarbamate
CID 2783435

Frequently Asked Questions

What is the IUPAC name of 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid?
The IUPAC name of 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid (CID 54597167) is 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid.
What is the SMILES notation for 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid?
The canonical SMILES for 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid is CN(c1ccc(CC(=O)O)cc1)c1ccccn1.
What is the InChIKey of 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid?
The InChIKey is JLPGJNGFKDXQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-16(13-4-2-3-9-15-13)12-7-5-11(6-8-12)10-14(17)18/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid?
2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid has a molecular weight of 242.28 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid is sourced from PubChem (CID 54597167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).