N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide

C23H26FN3O2 — CID 146394809

About N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide

N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 146394809) has the molecular formula C23H26FN3O2 and a molecular weight of 395.48 g/mol. Its IUPAC name is N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

• Compound Name: N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide
• PubChem CID: 146394809
• Molecular Formula: C23H26FN3O2
• Molecular Weight: 395.48 g/mol
• Exact Mass: 395.20
• IUPAC Name: N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide
• SMILES: Cc1ccc(F)c2c1NC(C(=O)Nc1cccc(N3CCOC(C4CC4)C3)c1)C2
• InChI: InChI=1S/C23H26FN3O2/c1-14-5-8-19(24)18-12-20(26-22(14)18)23(28)25-16-3-2-4-17(11-16)27-9-10-29-21(13-27)15-6-7-15/h2-5,8,11,15,20-21,26H,6-7,9-10,12-13H2,1H3,(H,25,28)
• InChIKey: GSSRZCOCBFEDGJ-UHFFFAOYSA-N
• XLogP: 3.72
• TPSA: 53.60 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	395.48
LogP ≤ 5	3.72
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide?

The IUPAC name of N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide (CID 146394809) is N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide.

What is the SMILES notation for N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide?

The canonical SMILES for N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide is Cc1ccc(F)c2c1NC(C(=O)Nc1cccc(N3CCOC(C4CC4)C3)c1)C2.

What is the InChIKey of N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide?

The InChIKey is GSSRZCOCBFEDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26FN3O2/c1-14-5-8-19(24)18-12-20(26-22(14)18)23(28)25-16-3-2-4-17(11-16)27-9-10-29-21(13-27)15-6-7-15/h2-5,8,11,15,20-21,26H,6-7,9-10,12-13H2,1H3,(H,25,28).

What are the key properties of N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide?

N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 395.48 g/mol, XLogP of 3.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(2-cyclopropylmorpholin-4-yl)phenyl]-4-fluoro-7-methyl-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 146394809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).