6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid

C12H15N3O3 — CID 117099190

IUPAC6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCCN(CCO)c1ccc2nc(C(=O)O)cn2c1
InChIInChI=1S/C12H15N3O3/c1-2-14(5-6-16)9-3-4-11-13-10(12(17)18)8-15(11)7-9/h3-4,7-8,16H,2,5-6H2,1H3,(H,17,18)
InChIKeyCURFMHACVSWBDH-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.85
Rot. Bonds5

About 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid

6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 117099190) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID117099190
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC Name6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCCN(CCO)c1ccc2nc(C(=O)O)cn2c1
InChIInChI=1S/C12H15N3O3/c1-2-14(5-6-16)9-3-4-11-13-10(12(17)18)8-15(11)7-9/h3-4,7-8,16H,2,5-6H2,1H3,(H,17,18)
InChIKeyCURFMHACVSWBDH-UHFFFAOYSA-N
XLogP0.85
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[butyl(ethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid
CID 117099179
6-[2-carboxyethyl(methyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid
CID 117099199
6-[butyl(ethyl)amino]-8-methylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 117099294
6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 68615554
6-formylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 23155605
6-[2-carboxyethyl(ethyl)amino]-2-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 117099226
4-[ethyl(2-hydroxyethyl)amino]-2-methylbenzoic acid
CID 112694436
6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid
CID 138634473
3-chloro-6-[ethyl(2-hydroxyethyl)amino]pyridine-2-carboxylic acid
CID 60980382
6-amino-N,N-diethylimidazo[1,2-a]pyridine-2-carboxamide
CID 82057688
ethyl 6-[bis(methylsulfonyl)amino]imidazo[1,2-a]pyridine-2-carboxylate
CID 131732205
[4-[ethyl(2-hydroxyethyl)amino]phenyl]azanium
CID 143733505

Frequently Asked Questions

What is the IUPAC name of 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid (CID 117099190) is 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid is CCN(CCO)c1ccc2nc(C(=O)O)cn2c1.
What is the InChIKey of 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is CURFMHACVSWBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3/c1-2-14(5-6-16)9-3-4-11-13-10(12(17)18)8-15(11)7-9/h3-4,7-8,16H,2,5-6H2,1H3,(H,17,18).
What are the key properties of 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid?
6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 249.27 g/mol, XLogP of 0.85, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethyl(2-hydroxyethyl)amino]imidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 117099190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).