N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide

C24H28N4O4 — CID 90461181

About N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide

N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 90461181) has the molecular formula C24H28N4O4 and a molecular weight of 436.51 g/mol. Its IUPAC name is N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
• PubChem CID: 90461181
• Molecular Formula: C24H28N4O4
• Molecular Weight: 436.51 g/mol
• Exact Mass: 436.21
• IUPAC Name: N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
• SMILES: Cc1ccc(NC(=O)c2cc(C(C)C)on2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1
• InChI: InChI=1S/C24H28N4O4/c1-15(2)22-13-20(26-32-22)23(29)25-18-6-5-16(3)19(12-18)17-11-21(24(30)27(4)14-17)28-7-9-31-10-8-28/h5-6,11-15H,7-10H2,1-4H3,(H,25,29)
• InChIKey: ZEDGADXCYUSDJB-UHFFFAOYSA-N
• XLogP: 3.56
• TPSA: 89.60 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	436.51
LogP ≤ 5	3.56
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?

The IUPAC name of N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide (CID 90461181) is N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide.

What is the SMILES notation for N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?

The canonical SMILES for N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide is Cc1ccc(NC(=O)c2cc(C(C)C)on2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.

What is the InChIKey of N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?

The InChIKey is ZEDGADXCYUSDJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O4/c1-15(2)22-13-20(26-32-22)23(29)25-18-6-5-16(3)19(12-18)17-11-21(24(30)27(4)14-17)28-7-9-31-10-8-28/h5-6,11-15H,7-10H2,1-4H3,(H,25,29).

What are the key properties of N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide?

N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 436.51 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 90461181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).