2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid

C10H12N2O4 — CID 146134067

IUPAC2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid
SMILESCc1ccn(CC(=O)NCC(=O)O)c(=O)c1
InChIInChI=1S/C10H12N2O4/c1-7-2-3-12(9(14)4-7)6-8(13)11-5-10(15)16/h2-4H,5-6H2,1H3,(H,11,13)(H,15,16)
InChIKeyXGXGGDCHQMKRTL-UHFFFAOYSA-N
MW224.22 g/mol
LogP-0.64
Rot. Bonds4

About 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid

2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid (PubChem CID 146134067) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid
PubChem CID146134067
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC Name2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid
SMILESCc1ccn(CC(=O)NCC(=O)O)c(=O)c1
InChIInChI=1S/C10H12N2O4/c1-7-2-3-12(9(14)4-7)6-8(13)11-5-10(15)16/h2-4H,5-6H2,1H3,(H,11,13)(H,15,16)
InChIKeyXGXGGDCHQMKRTL-UHFFFAOYSA-N
XLogP-0.64
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(4-methyl-2-oxo-1-pyridinyl)acetate;2-(4-methyl-2-oxo-1-pyridinyl)acetic acid
CID 160822702
methyl 2-(4-methyl-2-oxo-1-pyridinyl)acetate
CID 59562280
2-(4-methyl-2-oxo-1-pyridinyl)-N-[3-(3-methylphenoxy)propyl]acetamide
CID 71968867
N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962839
(2S)-N-methyl-2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]-2-phenylacetamide
CID 97007888
N-(2-aminophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962477
N-(3-bromophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 115614106
N-(4-amino-2-methylphenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962656
2-[4-[(4-methyl-2-oxo-1-pyridinyl)methyl]phenyl]acetic acid
CID 68750620
1-[2-(cyanomethylamino)-2-oxoethyl]-2-oxopyridine-4-carboxylic acid
CID 82898006
1-[2-(2-methylpropylamino)-2-oxoethyl]-2-oxopyridine-4-carboxylic acid
CID 82901827
1-(2-cyclopentyl-2-oxoethyl)-4-methylpyridin-2-one
CID 104751405

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid (CID 146134067) is 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid is Cc1ccn(CC(=O)NCC(=O)O)c(=O)c1.
What is the InChIKey of 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid?
The InChIKey is XGXGGDCHQMKRTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O4/c1-7-2-3-12(9(14)4-7)6-8(13)11-5-10(15)16/h2-4H,5-6H2,1H3,(H,11,13)(H,15,16).
What are the key properties of 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid?
2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid has a molecular weight of 224.22 g/mol, XLogP of -0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]amino]acetic acid is sourced from PubChem (CID 146134067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).