N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide

C19H18N4O3 — CID 31008366

IUPACN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
SMILESO=C(CCn1c(=O)oc2ccccc21)NCCc1cn2ccccc2n1
InChIInChI=1S/C19H18N4O3/c24-18(9-12-23-15-5-1-2-6-16(15)26-19(23)25)20-10-8-14-13-22-11-4-3-7-17(22)21-14/h1-7,11,13H,8-10,12H2,(H,20,24)
InChIKeyXOQLTCRHBBZXRP-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.99
Rot. Bonds6

About N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide

N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide (PubChem CID 31008366) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide.

Molecular Properties

Compound NameN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
PubChem CID31008366
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC NameN-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
SMILESO=C(CCn1c(=O)oc2ccccc21)NCCc1cn2ccccc2n1
InChIInChI=1S/C19H18N4O3/c24-18(9-12-23-15-5-1-2-6-16(15)26-19(23)25)20-10-8-14-13-22-11-4-3-7-17(22)21-14/h1-7,11,13H,8-10,12H2,(H,20,24)
InChIKeyXOQLTCRHBBZXRP-UHFFFAOYSA-N
XLogP1.99
TPSA81.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(benzimidazol-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)propanamide
CID 37275239
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 31124643
3-(2-oxo-1,3-benzoxazol-3-yl)-N-(3-phenylpropyl)propanamide
CID 27844689
3-(2-ethoxyphenyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)propanamide
CID 31008355
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-4-phenoxybutanamide
CID 31008224
N-tert-butyl-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
CID 51197823
N-[3-(4-hydroxypiperidin-1-yl)propyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
CID 111429592
2-(4-tert-butylphenyl)sulfanyl-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)acetamide
CID 31008586
N-(2-morpholin-4-ium-4-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide
CID 3622363
3-(2-oxo-1,3-benzoxazol-3-yl)-N-(oxolan-3-ylmethyl)propanamide
CID 53499763
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-[(2R)-morpholin-2-yl]acetamide
CID 125163664
4-(2-oxo-1,3-benzoxazol-3-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamide
CID 9021135

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide?
The IUPAC name of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide (CID 31008366) is N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide.
What is the SMILES notation for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide?
The canonical SMILES for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide is O=C(CCn1c(=O)oc2ccccc21)NCCc1cn2ccccc2n1.
What is the InChIKey of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide?
The InChIKey is XOQLTCRHBBZXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c24-18(9-12-23-15-5-1-2-6-16(15)26-19(23)25)20-10-8-14-13-22-11-4-3-7-17(22)21-14/h1-7,11,13H,8-10,12H2,(H,20,24).
What are the key properties of N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide?
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide has a molecular weight of 350.38 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide is sourced from PubChem (CID 31008366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).