5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid

C12H14N2O5 — CID 82786131

IUPAC5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid
SMILESCOC(=O)CCC(NC(=O)c1ccccn1)C(=O)O
InChIInChI=1S/C12H14N2O5/c1-19-10(15)6-5-9(12(17)18)14-11(16)8-4-2-3-7-13-8/h2-4,7,9H,5-6H2,1H3,(H,14,16)(H,17,18)
InChIKeySFJAVEKTYJIXPX-UHFFFAOYSA-N
MW266.25 g/mol
LogP0.22
Rot. Bonds6

About 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid

5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid (PubChem CID 82786131) has the molecular formula C12H14N2O5 and a molecular weight of 266.25 g/mol. Its IUPAC name is 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid.

Molecular Properties

Compound Name5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid
PubChem CID82786131
Molecular FormulaC12H14N2O5
Molecular Weight266.25 g/mol
Exact Mass266.09
IUPAC Name5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid
SMILESCOC(=O)CCC(NC(=O)c1ccccn1)C(=O)O
InChIInChI=1S/C12H14N2O5/c1-19-10(15)6-5-9(12(17)18)14-11(16)8-4-2-3-7-13-8/h2-4,7,9H,5-6H2,1H3,(H,14,16)(H,17,18)
InChIKeySFJAVEKTYJIXPX-UHFFFAOYSA-N
XLogP0.22
TPSA105.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.25
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-[(6-chloropyridine-2-carbonyl)amino]-5-methoxy-5-oxopentanoic acid
CID 107820235
5-methoxy-5-oxo-2-(pyrazine-2-carbonylamino)pentanoic acid
CID 82786676
(2R)-2-[(5-chloropyridine-2-carbonyl)amino]-5-methoxy-5-oxopentanoic acid
CID 107820649
(2S)-2-benzamido-5-methoxy-5-oxopentanoic acid
CID 10923432
5-methoxy-2-[(3-methylpyridine-2-carbonyl)amino]-5-oxopentanoic acid
CID 82786990
(2R)-5-methoxy-2-[(2-methylpyridine-3-carbonyl)amino]-5-oxopentanoic acid
CID 107820710
(2R)-2-[(2-hydroxybenzoyl)amino]-5-methoxy-5-oxopentanoic acid
CID 107820728
(2R)-5-methoxy-5-oxo-2-[(6-oxo-1H-pyrazine-3-carbonyl)amino]pentanoic acid
CID 107820744
(2S)-5-methoxy-5-oxo-2-(1H-pyrazole-5-carbonylamino)pentanoic acid
CID 107820339
5-methoxy-5-oxo-2-[(2-phenoxyacetyl)amino]pentanoic acid
CID 82780603
(2R)-5-methoxy-5-oxo-2-(thiophene-2-carbonylamino)pentanoic acid
CID 107820841
(2R)-2-[(2,6-difluorobenzoyl)amino]-5-methoxy-5-oxopentanoic acid
CID 107820571

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid?
The IUPAC name of 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid (CID 82786131) is 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid.
What is the SMILES notation for 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid?
The canonical SMILES for 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid is COC(=O)CCC(NC(=O)c1ccccn1)C(=O)O.
What is the InChIKey of 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid?
The InChIKey is SFJAVEKTYJIXPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O5/c1-19-10(15)6-5-9(12(17)18)14-11(16)8-4-2-3-7-13-8/h2-4,7,9H,5-6H2,1H3,(H,14,16)(H,17,18).
What are the key properties of 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid?
5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid has a molecular weight of 266.25 g/mol, XLogP of 0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-5-oxo-2-(pyridine-2-carbonylamino)pentanoic acid is sourced from PubChem (CID 82786131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).