2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid

C10H8N2O3S — CID 66952677

IUPAC2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid
SMILESO=C(O)CNC(=O)c1cnc2ccsc2c1
InChIInChI=1S/C10H8N2O3S/c13-9(14)5-12-10(15)6-3-8-7(11-4-6)1-2-16-8/h1-4H,5H2,(H,12,15)(H,13,14)
InChIKeyZJAWDIBQLWVOJU-UHFFFAOYSA-N
MW236.25 g/mol
LogP1.11
Rot. Bonds3

About 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid

2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid (PubChem CID 66952677) has the molecular formula C10H8N2O3S and a molecular weight of 236.25 g/mol. Its IUPAC name is 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid.

Molecular Properties

Compound Name2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid
PubChem CID66952677
Molecular FormulaC10H8N2O3S
Molecular Weight236.25 g/mol
Exact Mass236.03
IUPAC Name2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid
SMILESO=C(O)CNC(=O)c1cnc2ccsc2c1
InChIInChI=1S/C10H8N2O3S/c13-9(14)5-12-10(15)6-3-8-7(11-4-6)1-2-16-8/h1-4H,5H2,(H,12,15)(H,13,14)
InChIKeyZJAWDIBQLWVOJU-UHFFFAOYSA-N
XLogP1.11
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-thieno[3,2-b]pyridin-6-ylbut-3-yn-1-one
CID 81147974
phenyl(thieno[3,2-b]pyridin-6-yl)methanone
CID 81147858
2-(1-thieno[3,2-b]pyridin-6-ylethylamino)acetic acid
CID 64828783
2-(thieno[3,2-b]pyridine-5-carbonylamino)acetic acid
CID 66952658
2-[(6-fluoroquinoline-3-carbonyl)amino]acetic acid
CID 110489772
3-methylidene-1-thieno[3,2-b]pyridin-6-ylpentan-1-one
CID 81147598
1-thieno[3,2-b]pyridin-6-ylhexan-1-one
CID 81148126
(4-ethylphenyl)-thieno[3,2-b]pyridin-6-ylmethanone
CID 81148407
3-cyclopropyl-1-thieno[3,2-b]pyridin-6-ylpropan-1-one
CID 81146669
N-(2-hydroxyethyl)-N-(2-phenylethyl)thieno[3,2-b]pyridine-6-carboxamide
CID 71991218
2-[(6-(18F)fluoropyridine-3-carbonyl)amino]acetic acid
CID 175904627
2-cyclohexyl-1-thieno[3,2-b]pyridin-6-ylethanone
CID 81146664

Frequently Asked Questions

What is the IUPAC name of 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid?
The IUPAC name of 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid (CID 66952677) is 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid.
What is the SMILES notation for 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid?
The canonical SMILES for 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid is O=C(O)CNC(=O)c1cnc2ccsc2c1.
What is the InChIKey of 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid?
The InChIKey is ZJAWDIBQLWVOJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3S/c13-9(14)5-12-10(15)6-3-8-7(11-4-6)1-2-16-8/h1-4H,5H2,(H,12,15)(H,13,14).
What are the key properties of 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid?
2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid has a molecular weight of 236.25 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thieno[3,2-b]pyridine-6-carbonylamino)acetic acid is sourced from PubChem (CID 66952677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).