(2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide

C18H19N3O3 — CID 122192196

IUPAC(2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide
SMILESCNC(=O)[C@H]1Cc2ccccc2N1C(=O)COc1cnccc1C
InChIInChI=1S/C18H19N3O3/c1-12-7-8-20-10-16(12)24-11-17(22)21-14-6-4-3-5-13(14)9-15(21)18(23)19-2/h3-8,10,15H,9,11H2,1-2H3,(H,19,23)/t15-/m1/s1
InChIKeyMLRZQOPWQYVUNE-OAHLLOKOSA-N
MW325.37 g/mol
LogP1.47
Rot. Bonds4

About (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide

(2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide (PubChem CID 122192196) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide
PubChem CID122192196
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name(2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide
SMILESCNC(=O)[C@H]1Cc2ccccc2N1C(=O)COc1cnccc1C
InChIInChI=1S/C18H19N3O3/c1-12-7-8-20-10-16(12)24-11-17(22)21-14-6-4-3-5-13(14)9-15(21)18(23)19-2/h3-8,10,15H,9,11H2,1-2H3,(H,19,23)/t15-/m1/s1
InChIKeyMLRZQOPWQYVUNE-OAHLLOKOSA-N
XLogP1.47
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide?
The IUPAC name of (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide (CID 122192196) is (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide.
What is the SMILES notation for (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide?
The canonical SMILES for (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide is CNC(=O)[C@H]1Cc2ccccc2N1C(=O)COc1cnccc1C.
What is the InChIKey of (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide?
The InChIKey is MLRZQOPWQYVUNE-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-12-7-8-20-10-16(12)24-11-17(22)21-14-6-4-3-5-13(14)9-15(21)18(23)19-2/h3-8,10,15H,9,11H2,1-2H3,(H,19,23)/t15-/m1/s1.
What are the key properties of (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide?
(2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-1-[2-[(4-methyl-3-pyridinyl)oxy]acetyl]-2,3-dihydroindole-2-carboxamide is sourced from PubChem (CID 122192196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).