6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide

C22H27N3O2 — CID 11494330

IUPAC6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1ccc(Oc2ccc3c(c2)CC(N2[C@@H](C)CC[C@@H]2C)C3)nc1
InChIInChI=1S/C22H27N3O2/c1-14-4-5-15(2)25(14)19-10-16-6-8-20(12-18(16)11-19)27-21-9-7-17(13-24-21)22(26)23-3/h6-9,12-15,19H,4-5,10-11H2,1-3H3,(H,23,26)/t14-,15-,19?/m0/s1
InChIKeyDHWXKOKYEYBMOF-YIYRCGFGSA-N
MW365.48 g/mol
LogP3.57
Rot. Bonds4

About 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide

6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide (PubChem CID 11494330) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide
PubChem CID11494330
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1ccc(Oc2ccc3c(c2)CC(N2[C@@H](C)CC[C@@H]2C)C3)nc1
InChIInChI=1S/C22H27N3O2/c1-14-4-5-15(2)25(14)19-10-16-6-8-20(12-18(16)11-19)27-21-9-7-17(13-24-21)22(26)23-3/h6-9,12-15,19H,4-5,10-11H2,1-3H3,(H,23,26)/t14-,15-,19?/m0/s1
InChIKeyDHWXKOKYEYBMOF-YIYRCGFGSA-N
XLogP3.57
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide with MolForge

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Related Compounds

6-[(3-cyclopentyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]-N-methylpyridine-3-carboxamide
CID 10428924
N-methyl-6-[[3-(2-methylcyclopentyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxy]pyridine-3-carboxamide
CID 10429809
N-propan-2-yl-6-[(2-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-yl)oxy]pyridine-3-carboxamide
CID 11588670
(2R,5R)-1-(5-methoxy-2,3-dihydro-1H-inden-2-yl)-2,5-dimethylpyrrolidine
CID 69028967
N-methyl-6-[[1-oxo-2-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinolin-6-yl]oxy]pyridine-3-carboxamide;hydrochloride
CID 69084721
6-[4-(1,1,2,2,3,3,3-heptafluoropropyl)phenoxy]-N-methylpyridine-3-carboxamide
CID 146305828
6-[[2-(pentylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide
CID 66672841
1-[6-(2,3-dihydro-1H-isoindol-5-yloxy)-3-pyridinyl]ethanone
CID 142876508
5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]-N-methylpyrimidine-2-carboxamide
CID 68506288
6-[(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)oxy]pyridine-3-carboxamide
CID 59730393
N-methyl-6-propoxypyridine-3-carboxamide
CID 66904923
6-(2,3-dihydro-1H-isoindol-5-yloxy)pyridine-3-carboxamide
CID 59730173

Frequently Asked Questions

What is the IUPAC name of 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide (CID 11494330) is 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide is CNC(=O)c1ccc(Oc2ccc3c(c2)CC(N2[C@@H](C)CC[C@@H]2C)C3)nc1.
What is the InChIKey of 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide?
The InChIKey is DHWXKOKYEYBMOF-YIYRCGFGSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-14-4-5-15(2)25(14)19-10-16-6-8-20(12-18(16)11-19)27-21-9-7-17(13-24-21)22(26)23-3/h6-9,12-15,19H,4-5,10-11H2,1-3H3,(H,23,26)/t14-,15-,19?/m0/s1.
What are the key properties of 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide?
6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-yl]oxy]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 11494330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).