2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid

C15H20N2O4 — CID 107338759

IUPAC2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid
SMILESCCOC1CC(CC(=O)Nc2ccc(CC(=O)O)nc2)C1
InChIInChI=1S/C15H20N2O4/c1-2-21-13-5-10(6-13)7-14(18)17-12-4-3-11(16-9-12)8-15(19)20/h3-4,9-10,13H,2,5-8H2,1H3,(H,17,18)(H,19,20)
InChIKeyINRKZGODSFNQMK-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.85
Rot. Bonds7

About 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid

2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid (PubChem CID 107338759) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid.

Molecular Properties

Compound Name2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid
PubChem CID107338759
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid
SMILESCCOC1CC(CC(=O)Nc2ccc(CC(=O)O)nc2)C1
InChIInChI=1S/C15H20N2O4/c1-2-21-13-5-10(6-13)7-14(18)17-12-4-3-11(16-9-12)8-15(19)20/h3-4,9-10,13H,2,5-8H2,1H3,(H,17,18)(H,19,20)
InChIKeyINRKZGODSFNQMK-UHFFFAOYSA-N
XLogP1.85
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-[(2-cyclopropylacetyl)amino]-2-pyridinyl]acetic acid
CID 107338810
2-[4-[[2-(3-ethoxycyclobutyl)acetyl]amino]phenyl]acetic acid
CID 103161737
2-[5-(ethoxycarbonylamino)-2-pyridinyl]acetic acid
CID 107339556
N-(3-amino-4-ethylphenyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103161581
2-[5-[[2-(oxolan-2-yl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107339211
2-(3-ethoxycyclobutyl)-N-(4-sulfamoylphenyl)acetamide
CID 103164408
2-bromo-5-[[2-(3-ethoxycyclobutyl)acetyl]amino]benzoic acid
CID 103162104
N-(5-chloropyrazin-2-yl)-2-(3-ethoxycyclobutyl)acetamide
CID 107595662
2-[5-[[2-(2-methoxyethylamino)acetyl]amino]-2-pyridinyl]acetic acid
CID 107340978
2-[[2-(3-ethoxycyclobutyl)acetyl]amino]pyridine-4-carboxylic acid
CID 103161966
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

Frequently Asked Questions

What is the IUPAC name of 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid?
The IUPAC name of 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid (CID 107338759) is 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid.
What is the SMILES notation for 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid?
The canonical SMILES for 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid is CCOC1CC(CC(=O)Nc2ccc(CC(=O)O)nc2)C1.
What is the InChIKey of 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid?
The InChIKey is INRKZGODSFNQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-2-21-13-5-10(6-13)7-14(18)17-12-4-3-11(16-9-12)8-15(19)20/h3-4,9-10,13H,2,5-8H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid?
2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid has a molecular weight of 292.34 g/mol, XLogP of 1.85, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[[2-(3-ethoxycyclobutyl)acetyl]amino]-2-pyridinyl]acetic acid is sourced from PubChem (CID 107338759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).