4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide

C19H19ClN2O4 — CID 51316375

About 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide

4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide (PubChem CID 51316375) has the molecular formula C19H19ClN2O4 and a molecular weight of 374.82 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide.

Molecular Properties

• Compound Name: 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide
• PubChem CID: 51316375
• Molecular Formula: C19H19ClN2O4
• Molecular Weight: 374.82 g/mol
• Exact Mass: 374.10
• IUPAC Name: 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide
• SMILES: COc1cc(C(=O)NC2CCc3ccccc32)cc(Cl)c1OCC(N)=O
• InChI: InChI=1S/C19H19ClN2O4/c1-25-16-9-12(8-14(20)18(16)26-10-17(21)23)19(24)22-15-7-6-11-4-2-3-5-13(11)15/h2-5,8-9,15H,6-7,10H2,1H3,(H2,21,23)(H,22,24)
• InChIKey: CCQSOWADMAZVFF-UHFFFAOYSA-N
• XLogP: 2.63
• TPSA: 90.65 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	374.82
LogP ≤ 5	2.63
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide?

The IUPAC name of 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide (CID 51316375) is 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide.

What is the SMILES notation for 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide?

The canonical SMILES for 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide is COc1cc(C(=O)NC2CCc3ccccc32)cc(Cl)c1OCC(N)=O.

What is the InChIKey of 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide?

The InChIKey is CCQSOWADMAZVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O4/c1-25-16-9-12(8-14(20)18(16)26-10-17(21)23)19(24)22-15-7-6-11-4-2-3-5-13(11)15/h2-5,8-9,15H,6-7,10H2,1H3,(H2,21,23)(H,22,24).

What are the key properties of 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide?

4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide has a molecular weight of 374.82 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(2-amino-2-oxoethoxy)-3-chloro-N-(2,3-dihydro-1H-inden-1-yl)-5-methoxybenzamide is sourced from PubChem (CID 51316375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).