2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide

C18H23N3O4 — CID 91759864

About 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide

2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 91759864) has the molecular formula C18H23N3O4 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

• Compound Name: 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide
• PubChem CID: 91759864
• Molecular Formula: C18H23N3O4
• Molecular Weight: 345.40 g/mol
• Exact Mass: 345.17
• IUPAC Name: 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide
• SMILES: CCc1nc(C)c(C(=O)NC(c2ccc(OC)nc2)C2CC(O)C2)o1
• InChI: InChI=1S/C18H23N3O4/c1-4-14-20-10(2)17(25-14)18(23)21-16(12-7-13(22)8-12)11-5-6-15(24-3)19-9-11/h5-6,9,12-13,16,22H,4,7-8H2,1-3H3,(H,21,23)
• InChIKey: PZLTYAWAAZDJOE-UHFFFAOYSA-N
• XLogP: 2.19
• TPSA: 97.48 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	345.40
LogP ≤ 5	2.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide?

The IUPAC name of 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide (CID 91759864) is 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide.

What is the SMILES notation for 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide?

The canonical SMILES for 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide is CCc1nc(C)c(C(=O)NC(c2ccc(OC)nc2)C2CC(O)C2)o1.

What is the InChIKey of 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide?

The InChIKey is PZLTYAWAAZDJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O4/c1-4-14-20-10(2)17(25-14)18(23)21-16(12-7-13(22)8-12)11-5-6-15(24-3)19-9-11/h5-6,9,12-13,16,22H,4,7-8H2,1-3H3,(H,21,23).

What are the key properties of 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide?

2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 345.40 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 91759864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).