3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide

C23H23N5O3 — CID 66649764

IUPAC3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(-c2cc(C(=O)NCc3cnc(C)cn3)cc(N3C(=O)OCC3C)c2)nc1
InChIInChI=1S/C23H23N5O3/c1-14-4-5-21(26-9-14)17-6-18(8-20(7-17)28-16(3)13-31-23(28)30)22(29)27-12-19-11-24-15(2)10-25-19/h4-11,16H,12-13H2,1-3H3,(H,27,29)
InChIKeyPXANXYYTAVWYAK-UHFFFAOYSA-N
MW417.47 g/mol
LogP3.43
Rot. Bonds5

About 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide

3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide (PubChem CID 66649764) has the molecular formula C23H23N5O3 and a molecular weight of 417.47 g/mol. Its IUPAC name is 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide
PubChem CID66649764
Molecular FormulaC23H23N5O3
Molecular Weight417.47 g/mol
Exact Mass417.18
IUPAC Name3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(-c2cc(C(=O)NCc3cnc(C)cn3)cc(N3C(=O)OCC3C)c2)nc1
InChIInChI=1S/C23H23N5O3/c1-14-4-5-21(26-9-14)17-6-18(8-20(7-17)28-16(3)13-31-23(28)30)22(29)27-12-19-11-24-15(2)10-25-19/h4-11,16H,12-13H2,1-3H3,(H,27,29)
InChIKeyPXANXYYTAVWYAK-UHFFFAOYSA-N
XLogP3.43
TPSA97.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide?
The IUPAC name of 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide (CID 66649764) is 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide is Cc1ccc(-c2cc(C(=O)NCc3cnc(C)cn3)cc(N3C(=O)OCC3C)c2)nc1.
What is the InChIKey of 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide?
The InChIKey is PXANXYYTAVWYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O3/c1-14-4-5-21(26-9-14)17-6-18(8-20(7-17)28-16(3)13-31-23(28)30)22(29)27-12-19-11-24-15(2)10-25-19/h4-11,16H,12-13H2,1-3H3,(H,27,29).
What are the key properties of 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide?
3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide has a molecular weight of 417.47 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)-N-[(5-methylpyrazin-2-yl)methyl]-5-(5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 66649764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).