3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid

C11H14N2O5 — CID 43353726

IUPAC3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid
SMILESCOc1ccc(C(=O)NC(C(=O)O)C(C)O)cn1
InChIInChI=1S/C11H14N2O5/c1-6(14)9(11(16)17)13-10(15)7-3-4-8(18-2)12-5-7/h3-6,9,14H,1-2H3,(H,13,15)(H,16,17)
InChIKeyKBNMIVCHNPSZHD-UHFFFAOYSA-N
MW254.24 g/mol
LogP-0.35
Rot. Bonds5

About 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid

3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid (PubChem CID 43353726) has the molecular formula C11H14N2O5 and a molecular weight of 254.24 g/mol. Its IUPAC name is 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid.

Molecular Properties

Compound Name3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid
PubChem CID43353726
Molecular FormulaC11H14N2O5
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC Name3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid
SMILESCOc1ccc(C(=O)NC(C(=O)O)C(C)O)cn1
InChIInChI=1S/C11H14N2O5/c1-6(14)9(11(16)17)13-10(15)7-3-4-8(18-2)12-5-7/h3-6,9,14H,1-2H3,(H,13,15)(H,16,17)
InChIKeyKBNMIVCHNPSZHD-UHFFFAOYSA-N
XLogP-0.35
TPSA108.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-bromopyridine-3-carbonyl)amino]-3-hydroxybutanoic acid
CID 66465881
3-hydroxy-2-[(6-methylpyridine-3-carbonyl)amino]butanoic acid
CID 16784411
2-[[6-(dimethylamino)pyridine-3-carbonyl]amino]-3-hydroxybutanoic acid
CID 43353682
(2S)-2-[(6-methoxypyridine-3-carbonyl)amino]-2-phenylacetic acid
CID 93310081
(2R)-5-methoxy-2-[(6-methoxypyridine-3-carbonyl)amino]-5-oxopentanoic acid
CID 107820810
N-[1-(4-fluorophenyl)ethyl]-6-methoxypyridine-3-carboxamide
CID 134016008
N-[1-(4-bromophenyl)ethyl]-6-methoxypyridine-3-carboxamide
CID 47124570
(2R)-2-[(6-methoxypyridine-3-carbonyl)amino]-4-methylsulfanylbutanoic acid
CID 104906521
(2R,3S)-3-hydroxy-2-(pyridine-3-carbonylamino)butanoic acid
CID 843815
3-hydroxy-2-[[4-(methoxymethyl)benzoyl]amino]butanoic acid
CID 43238754
6-methoxy-N-(1-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 24645455
(2S,3R)-2-[(4-bromo-3,5-dimethoxybenzoyl)amino]-3-hydroxybutanoic acid
CID 104964557

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid?
The IUPAC name of 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid (CID 43353726) is 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid.
What is the SMILES notation for 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid?
The canonical SMILES for 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid is COc1ccc(C(=O)NC(C(=O)O)C(C)O)cn1.
What is the InChIKey of 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid?
The InChIKey is KBNMIVCHNPSZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O5/c1-6(14)9(11(16)17)13-10(15)7-3-4-8(18-2)12-5-7/h3-6,9,14H,1-2H3,(H,13,15)(H,16,17).
What are the key properties of 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid?
3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid has a molecular weight of 254.24 g/mol, XLogP of -0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid is sourced from PubChem (CID 43353726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).