2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide

C19H23N3O4 — CID 91764734

About 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide

2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 91764734) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide
• PubChem CID: 91764734
• Molecular Formula: C19H23N3O4
• Molecular Weight: 357.41 g/mol
• Exact Mass: 357.17
• IUPAC Name: 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide
• SMILES: CCc1cc(C(=O)NC(c2cncc(OC)c2)C2CC(O)C2)cc(=O)[nH]1
• InChI: InChI=1S/C19H23N3O4/c1-3-14-4-12(8-17(24)21-14)19(25)22-18(11-5-15(23)6-11)13-7-16(26-2)10-20-9-13/h4,7-11,15,18,23H,3,5-6H2,1-2H3,(H,21,24)(H,22,25)
• InChIKey: YIQYEIZMECGOQX-UHFFFAOYSA-N
• XLogP: 1.58
• TPSA: 104.31 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	357.41
LogP ≤ 5	1.58
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide (CID 91764734) is 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide.

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

The canonical SMILES for 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide is CCc1cc(C(=O)NC(c2cncc(OC)c2)C2CC(O)C2)cc(=O)[nH]1.

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

The InChIKey is YIQYEIZMECGOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-3-14-4-12(8-17(24)21-14)19(25)22-18(11-5-15(23)6-11)13-7-16(26-2)10-20-9-13/h4,7-11,15,18,23H,3,5-6H2,1-2H3,(H,21,24)(H,22,25).

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

2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 1.58, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 91764734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).