3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide

C24H22N6O5 — CID 135334377

IUPAC3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide
SMILESCc1cc(C2OC=C(C(N)=O)N2c2cc3oc(N4CCOCC4)nc3nc2-c2ccoc2)ccn1
InChIInChI=1S/C24H22N6O5/c1-14-10-15(2-4-26-14)23-30(18(13-34-23)21(25)31)17-11-19-22(27-20(17)16-3-7-33-12-16)28-24(35-19)29-5-8-32-9-6-29/h2-4,7,10-13,23H,5-6,8-9H2,1H3,(H2,25,31)
InChIKeyHNKVALTUGKSFRX-UHFFFAOYSA-N
MW474.48 g/mol
LogP2.88
Rot. Bonds5

About 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide

3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide (PubChem CID 135334377) has the molecular formula C24H22N6O5 and a molecular weight of 474.48 g/mol. Its IUPAC name is 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide
PubChem CID135334377
Molecular FormulaC24H22N6O5
Molecular Weight474.48 g/mol
Exact Mass474.17
IUPAC Name3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide
SMILESCc1cc(C2OC=C(C(N)=O)N2c2cc3oc(N4CCOCC4)nc3nc2-c2ccoc2)ccn1
InChIInChI=1S/C24H22N6O5/c1-14-10-15(2-4-26-14)23-30(18(13-34-23)21(25)31)17-11-19-22(27-20(17)16-3-7-33-12-16)28-24(35-19)29-5-8-32-9-6-29/h2-4,7,10-13,23H,5-6,8-9H2,1H3,(H2,25,31)
InChIKeyHNKVALTUGKSFRX-UHFFFAOYSA-N
XLogP2.88
TPSA132.98 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.48
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide?
The IUPAC name of 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide (CID 135334377) is 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide?
The canonical SMILES for 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide is Cc1cc(C2OC=C(C(N)=O)N2c2cc3oc(N4CCOCC4)nc3nc2-c2ccoc2)ccn1.
What is the InChIKey of 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide?
The InChIKey is HNKVALTUGKSFRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N6O5/c1-14-10-15(2-4-26-14)23-30(18(13-34-23)21(25)31)17-11-19-22(27-20(17)16-3-7-33-12-16)28-24(35-19)29-5-8-32-9-6-29/h2-4,7,10-13,23H,5-6,8-9H2,1H3,(H2,25,31).
What are the key properties of 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide?
3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide has a molecular weight of 474.48 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(furan-3-yl)-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-2H-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 135334377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).