3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid

C11H14N2O4 — CID 43360879

IUPAC3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid
SMILESCOc1ncccc1C(=O)NC(C)CC(=O)O
InChIInChI=1S/C11H14N2O4/c1-7(6-9(14)15)13-10(16)8-4-3-5-12-11(8)17-2/h3-5,7H,6H2,1-2H3,(H,13,16)(H,14,15)
InChIKeyQDCQGSQTZRTZSH-UHFFFAOYSA-N
MW238.24 g/mol
LogP0.68
Rot. Bonds5

About 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid

3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid (PubChem CID 43360879) has the molecular formula C11H14N2O4 and a molecular weight of 238.24 g/mol. Its IUPAC name is 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid.

Molecular Properties

Compound Name3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid
PubChem CID43360879
Molecular FormulaC11H14N2O4
Molecular Weight238.24 g/mol
Exact Mass238.10
IUPAC Name3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid
SMILESCOc1ncccc1C(=O)NC(C)CC(=O)O
InChIInChI=1S/C11H14N2O4/c1-7(6-9(14)15)13-10(16)8-4-3-5-12-11(8)17-2/h3-5,7H,6H2,1-2H3,(H,13,16)(H,14,15)
InChIKeyQDCQGSQTZRTZSH-UHFFFAOYSA-N
XLogP0.68
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2-ethoxypyridine-3-carbonyl)amino]butanoic acid
CID 119221242
N-(4-hydroxypentan-2-yl)-2-methoxypyridine-3-carboxamide
CID 113376564
4,4,4-trifluoro-3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid
CID 138057760
3-[(2-methoxypyridine-3-carbonyl)amino]-2-methylbutanoic acid
CID 113415816
methyl 3-hydroxy-2-[(2-methoxypyridine-3-carbonyl)amino]propanoate
CID 43423436
(3R)-3-[(2-methoxybenzoyl)amino]butanoic acid
CID 93262749
2-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 84580740
(2S)-2-[(2-methoxypyridine-3-carbonyl)amino]hexanoic acid
CID 107144610
N-[1-[4-(aminomethyl)phenyl]ethyl]-2-methoxypyridine-3-carboxamide
CID 62876323
2-methoxy-N-[4-(3-methylbutanoylamino)phenyl]pyridine-3-carboxamide
CID 134002839
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-2-methoxypyridine-3-carboxamide
CID 103940867
3-[(4,6-dimethoxypyrimidine-5-carbonyl)amino]butanoic acid
CID 119347873

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid?
The IUPAC name of 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid (CID 43360879) is 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid.
What is the SMILES notation for 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid?
The canonical SMILES for 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid is COc1ncccc1C(=O)NC(C)CC(=O)O.
What is the InChIKey of 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid?
The InChIKey is QDCQGSQTZRTZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O4/c1-7(6-9(14)15)13-10(16)8-4-3-5-12-11(8)17-2/h3-5,7H,6H2,1-2H3,(H,13,16)(H,14,15).
What are the key properties of 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid?
3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid has a molecular weight of 238.24 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxypyridine-3-carbonyl)amino]butanoic acid is sourced from PubChem (CID 43360879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).