2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid

C14H12N2O4 — CID 163226654

IUPAC2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C14H12N2O4/c17-13(18)9-16-14(19)10-6-7-12(15-8-10)20-11-4-2-1-3-5-11/h1-8H,9H2,(H,16,19)(H,17,18)
InChIKeyLLGRFGPWNIIRPZ-UHFFFAOYSA-N
MW272.26 g/mol
LogP1.69
Rot. Bonds5

About 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid

2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid (PubChem CID 163226654) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid
PubChem CID163226654
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C14H12N2O4/c17-13(18)9-16-14(19)10-6-7-12(15-8-10)20-11-4-2-1-3-5-11/h1-8H,9H2,(H,16,19)(H,17,18)
InChIKeyLLGRFGPWNIIRPZ-UHFFFAOYSA-N
XLogP1.69
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-6-phenoxypyridine-3-carboxamide
CID 87000425
N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
CID 78888027
N-[2-[(4-chlorobenzoyl)amino]ethyl]-6-phenoxypyridine-3-carboxamide
CID 78888100
2-ethyl-2-[[(6-phenoxypyridine-3-carbonyl)amino]methyl]butanoic acid
CID 120533319
6-phenoxy-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 87000850
N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 111539349
N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 111333099
N-[3-(2-methoxyethoxy)propyl]-6-phenoxypyridine-3-carboxamide
CID 87002549
ethyl 4-[(6-phenoxypyridine-3-carbonyl)amino]butanoate
CID 87002133
N-[[4-(butylcarbamoyl)phenyl]methyl]-6-phenoxypyridine-3-carboxamide
CID 78901073
ethane;1-(6-phenoxy-3-pyridinyl)ethanone
CID 91184231
N-[(2-ethoxy-4-pyridinyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 78899959

Frequently Asked Questions

What is the IUPAC name of 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid?
The IUPAC name of 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid (CID 163226654) is 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid is O=C(O)CNC(=O)c1ccc(Oc2ccccc2)nc1.
What is the InChIKey of 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid?
The InChIKey is LLGRFGPWNIIRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c17-13(18)9-16-14(19)10-6-7-12(15-8-10)20-11-4-2-1-3-5-11/h1-8H,9H2,(H,16,19)(H,17,18).
What are the key properties of 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid?
2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid has a molecular weight of 272.26 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid is sourced from PubChem (CID 163226654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).