N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide

C19H19N5O4 — CID 46937846

IUPACN-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide
SMILESO=C(NC1CCOCC1)c1cnc(OCc2conc2-c2ccccn2)cn1
InChIInChI=1S/C19H19N5O4/c25-19(23-14-4-7-26-8-5-14)16-9-22-17(10-21-16)27-11-13-12-28-24-18(13)15-3-1-2-6-20-15/h1-3,6,9-10,12,14H,4-5,7-8,11H2,(H,23,25)
InChIKeyXOJMZTRBFOSXKO-UHFFFAOYSA-N
MW381.39 g/mol
LogP2.01
Rot. Bonds6

About N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide

N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide (PubChem CID 46937846) has the molecular formula C19H19N5O4 and a molecular weight of 381.39 g/mol. Its IUPAC name is N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide
PubChem CID46937846
Molecular FormulaC19H19N5O4
Molecular Weight381.39 g/mol
Exact Mass381.14
IUPAC NameN-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide
SMILESO=C(NC1CCOCC1)c1cnc(OCc2conc2-c2ccccn2)cn1
InChIInChI=1S/C19H19N5O4/c25-19(23-14-4-7-26-8-5-14)16-9-22-17(10-21-16)27-11-13-12-28-24-18(13)15-3-1-2-6-20-15/h1-3,6,9-10,12,14H,4-5,7-8,11H2,(H,23,25)
InChIKeyXOJMZTRBFOSXKO-UHFFFAOYSA-N
XLogP2.01
TPSA112.26 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.39
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide?
The IUPAC name of N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide (CID 46937846) is N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide.
What is the SMILES notation for N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide?
The canonical SMILES for N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide is O=C(NC1CCOCC1)c1cnc(OCc2conc2-c2ccccn2)cn1.
What is the InChIKey of N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide?
The InChIKey is XOJMZTRBFOSXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O4/c25-19(23-14-4-7-26-8-5-14)16-9-22-17(10-21-16)27-11-13-12-28-24-18(13)15-3-1-2-6-20-15/h1-3,6,9-10,12,14H,4-5,7-8,11H2,(H,23,25).
What are the key properties of N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide?
N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide has a molecular weight of 381.39 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-4-yl)-5-[(3-pyridin-2-yl-1,2-oxazol-4-yl)methoxy]pyrazine-2-carboxamide is sourced from PubChem (CID 46937846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).