2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide

C22H21N3O2 — CID 113036618

IUPAC2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(N2c3ccccc3CC2C)cn1
InChIInChI=1S/C22H21N3O2/c1-15-13-16-7-3-5-9-19(16)25(15)17-11-12-21(23-14-17)24-22(26)18-8-4-6-10-20(18)27-2/h3-12,14-15H,13H2,1-2H3,(H,23,24,26)
InChIKeyXYWFQQSIUSPFEG-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.43
Rot. Bonds4

About 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide

2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide (PubChem CID 113036618) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide
PubChem CID113036618
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC Name2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(N2c3ccccc3CC2C)cn1
InChIInChI=1S/C22H21N3O2/c1-15-13-16-7-3-5-9-19(16)25(15)17-11-12-21(23-14-17)24-22(26)18-8-4-6-10-20(18)27-2/h3-12,14-15H,13H2,1-2H3,(H,23,24,26)
InChIKeyXYWFQQSIUSPFEG-UHFFFAOYSA-N
XLogP4.43
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide?
The IUPAC name of 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide (CID 113036618) is 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide?
The canonical SMILES for 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide is COc1ccccc1C(=O)Nc1ccc(N2c3ccccc3CC2C)cn1.
What is the InChIKey of 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide?
The InChIKey is XYWFQQSIUSPFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-15-13-16-7-3-5-9-19(16)25(15)17-11-12-21(23-14-17)24-22(26)18-8-4-6-10-20(18)27-2/h3-12,14-15H,13H2,1-2H3,(H,23,24,26).
What are the key properties of 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide?
2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide has a molecular weight of 359.43 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 113036618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).