2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide

C23H24ClN5O2 — CID 134809736

About 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide

2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide (PubChem CID 134809736) has the molecular formula C23H24ClN5O2 and a molecular weight of 437.93 g/mol. Its IUPAC name is 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide.

Molecular Properties

• Compound Name: 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide
• PubChem CID: 134809736
• Molecular Formula: C23H24ClN5O2
• Molecular Weight: 437.93 g/mol
• Exact Mass: 437.16
• IUPAC Name: 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide
• SMILES: CC(C)(Oc1nn(Cc2cccc(Cl)c2)c2ccccc12)C(=O)NCCc1cnc[nH]1
• InChI: InChI=1S/C23H24ClN5O2/c1-23(2,22(30)26-11-10-18-13-25-15-27-18)31-21-19-8-3-4-9-20(19)29(28-21)14-16-6-5-7-17(24)12-16/h3-9,12-13,15H,10-11,14H2,1-2H3,(H,25,27)(H,26,30)
• InChIKey: GUFJXWYFHFQMCY-UHFFFAOYSA-N
• XLogP: 3.98
• TPSA: 84.83 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	437.93
LogP ≤ 5	3.98
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide?

The IUPAC name of 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide (CID 134809736) is 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide.

What is the SMILES notation for 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide?

The canonical SMILES for 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide is CC(C)(Oc1nn(Cc2cccc(Cl)c2)c2ccccc12)C(=O)NCCc1cnc[nH]1.

What is the InChIKey of 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide?

The InChIKey is GUFJXWYFHFQMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN5O2/c1-23(2,22(30)26-11-10-18-13-25-15-27-18)31-21-19-8-3-4-9-20(19)29(28-21)14-16-6-5-7-17(24)12-16/h3-9,12-13,15H,10-11,14H2,1-2H3,(H,25,27)(H,26,30).

What are the key properties of 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide?

2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide has a molecular weight of 437.93 g/mol, XLogP of 3.98, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxy-N-[2-(1H-imidazol-5-yl)ethyl]-2-methylpropanamide is sourced from PubChem (CID 134809736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).