[6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone

C19H16FN5O3 — CID 70798531

IUPAC[6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
SMILESNc1nc2cc(-c3cc(F)c4ncc(C(=O)N5CCOCC5)n4c3)ccc2o1
InChIInChI=1S/C19H16FN5O3/c20-13-7-12(11-1-2-16-14(8-11)23-19(21)28-16)10-25-15(9-22-17(13)25)18(26)24-3-5-27-6-4-24/h1-2,7-10H,3-6H2,(H2,21,23)
InChIKeyQWQRHFZPIVWIEG-UHFFFAOYSA-N
MW381.37 g/mol
LogP2.34
Rot. Bonds2

About [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone

[6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone (PubChem CID 70798531) has the molecular formula C19H16FN5O3 and a molecular weight of 381.37 g/mol. Its IUPAC name is [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
PubChem CID70798531
Molecular FormulaC19H16FN5O3
Molecular Weight381.37 g/mol
Exact Mass381.12
IUPAC Name[6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
SMILESNc1nc2cc(-c3cc(F)c4ncc(C(=O)N5CCOCC5)n4c3)ccc2o1
InChIInChI=1S/C19H16FN5O3/c20-13-7-12(11-1-2-16-14(8-11)23-19(21)28-16)10-25-15(9-22-17(13)25)18(26)24-3-5-27-6-4-24/h1-2,7-10H,3-6H2,(H2,21,23)
InChIKeyQWQRHFZPIVWIEG-UHFFFAOYSA-N
XLogP2.34
TPSA98.89 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.37
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

MK-3328
CID 44555286
Serabelisib
CID 70798655
CA-4948
CID 118224238
N-(5-{(1s)-1-[(5-Fluoro-1,3-Benzoxazol-2-Yl)amino]ethyl}-2-Methylphenyl)imidazo[1,2-A]pyridine-3-Carboxamide
CID 86763813
7-chloro-2-ethyl-N-[[2-[4-(trifluoromethoxy)phenyl]-1,3-benzoxazol-5-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234666
1-ethyl-N-(5-ethyl-1,3-oxazol-2-yl)-2-[hydroxy(diphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridine-6-carboxamide
CID 164627154
6-chloro-2-ethyl-N-[[2-[4-(trifluoromethoxy)phenyl]-1,3-benzoxazol-5-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68235225
7-chloro-N-[(2-cyclohexyl-1,3-benzoxazol-5-yl)methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
CID 68235235
7-chloro-2-ethyl-N-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68235249
6-chloro-2-ethyl-N-[[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68235253
6-chloro-N-[(2-cyclohexyl-1,3-benzoxazol-5-yl)methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
CID 68235254
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone
CID 70798412

Frequently Asked Questions

What is the IUPAC name of [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone (CID 70798531) is [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone is Nc1nc2cc(-c3cc(F)c4ncc(C(=O)N5CCOCC5)n4c3)ccc2o1.
What is the InChIKey of [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is QWQRHFZPIVWIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O3/c20-13-7-12(11-1-2-16-14(8-11)23-19(21)28-16)10-25-15(9-22-17(13)25)18(26)24-3-5-27-6-4-24/h1-2,7-10H,3-6H2,(H2,21,23).
What are the key properties of [6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
[6-(2-amino-1,3-benzoxazol-5-yl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 381.37 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 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)-8-fluoroimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 70798531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).