6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide

C17H15N5O3 — CID 70798500

IUPAC6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESNc1nc2cc(-c3ccc4ncc(C(=O)NCCO)n4c3)ccc2o1
InChIInChI=1S/C17H15N5O3/c18-17-21-12-7-10(1-3-14(12)25-17)11-2-4-15-20-8-13(22(15)9-11)16(24)19-5-6-23/h1-4,7-9,23H,5-6H2,(H2,18,21)(H,19,24)
InChIKeyLTBPWUYLZYAIQV-UHFFFAOYSA-N
MW337.34 g/mol
LogP1.45
Rot. Bonds4

About 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide

6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 70798500) has the molecular formula C17H15N5O3 and a molecular weight of 337.34 g/mol. Its IUPAC name is 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID70798500
Molecular FormulaC17H15N5O3
Molecular Weight337.34 g/mol
Exact Mass337.12
IUPAC Name6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESNc1nc2cc(-c3ccc4ncc(C(=O)NCCO)n4c3)ccc2o1
InChIInChI=1S/C17H15N5O3/c18-17-21-12-7-10(1-3-14(12)25-17)11-2-4-15-20-8-13(22(15)9-11)16(24)19-5-6-23/h1-4,7-9,23H,5-6H2,(H2,18,21)(H,19,24)
InChIKeyLTBPWUYLZYAIQV-UHFFFAOYSA-N
XLogP1.45
TPSA118.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide (CID 70798500) is 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide is Nc1nc2cc(-c3ccc4ncc(C(=O)NCCO)n4c3)ccc2o1.
What is the InChIKey of 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LTBPWUYLZYAIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O3/c18-17-21-12-7-10(1-3-14(12)25-17)11-2-4-15-20-8-13(22(15)9-11)16(24)19-5-6-23/h1-4,7-9,23H,5-6H2,(H2,18,21)(H,19,24).
What are the key properties of 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide?
6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 337.34 g/mol, XLogP of 1.45, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-hydroxyethyl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 70798500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).