N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide

C24H28N4O5 — CID 42485555

About N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide

N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide (PubChem CID 42485555) has the molecular formula C24H28N4O5 and a molecular weight of 452.51 g/mol. Its IUPAC name is N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide.

Molecular Properties

• Compound Name: N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide
• PubChem CID: 42485555
• Molecular Formula: C24H28N4O5
• Molecular Weight: 452.51 g/mol
• Exact Mass: 452.21
• IUPAC Name: N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide
• SMILES: COCc1ccc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)Cc2c(C)noc2C)C3)o1
• InChI: InChI=1S/C24H28N4O5/c1-14-21(11-26-24(30)22-6-5-18(32-22)13-31-4)19-7-8-28(12-17(19)10-25-14)23(29)9-20-15(2)27-33-16(20)3/h5-6,10H,7-9,11-13H2,1-4H3,(H,26,30)
• InChIKey: BHGZGWOODNXIPS-UHFFFAOYSA-N
• XLogP: 2.79
• TPSA: 110.70 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	452.51
LogP ≤ 5	2.79
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide?

The IUPAC name of N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide (CID 42485555) is N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide.

What is the SMILES notation for N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide?

The canonical SMILES for N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide is COCc1ccc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)Cc2c(C)noc2C)C3)o1.

What is the InChIKey of N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide?

The InChIKey is BHGZGWOODNXIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O5/c1-14-21(11-26-24(30)22-6-5-18(32-22)13-31-4)19-7-8-28(12-17(19)10-25-14)23(29)9-20-15(2)27-33-16(20)3/h5-6,10H,7-9,11-13H2,1-4H3,(H,26,30).

What are the key properties of N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide?

N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide has a molecular weight of 452.51 g/mol, XLogP of 2.79, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[7-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 42485555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).