6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide

C20H23N3O2 — CID 97118952

IUPAC6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide
SMILESCn1c(C(N)=O)cc2c1CN(C(=O)C[C@H]1CCc3ccccc31)CC2
InChIInChI=1S/C20H23N3O2/c1-22-17(20(21)25)10-15-8-9-23(12-18(15)22)19(24)11-14-7-6-13-4-2-3-5-16(13)14/h2-5,10,14H,6-9,11-12H2,1H3,(H2,21,25)/t14-/m1/s1
InChIKeyGQXBIYHTCZNAEE-CQSZACIVSA-N
MW337.42 g/mol
LogP2.13
Rot. Bonds3

About 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide

6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide (PubChem CID 97118952) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide
PubChem CID97118952
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide
SMILESCn1c(C(N)=O)cc2c1CN(C(=O)C[C@H]1CCc3ccccc31)CC2
InChIInChI=1S/C20H23N3O2/c1-22-17(20(21)25)10-15-8-9-23(12-18(15)22)19(24)11-14-7-6-13-4-2-3-5-16(13)14/h2-5,10,14H,6-9,11-12H2,1H3,(H2,21,25)/t14-/m1/s1
InChIKeyGQXBIYHTCZNAEE-CQSZACIVSA-N
XLogP2.13
TPSA68.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[2-[(1S)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-(2-hydroxyethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 95206724
2-cyclohexyl-1-[4-[2-(2,3-dihydro-1H-inden-1-yl)acetyl]piperazin-1-yl]ethanone
CID 86955748
1-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-(2,3-dihydro-1H-inden-1-yl)ethanone
CID 86955427
2-(2,3-dihydro-1H-inden-1-yl)-1-(4-methylsulfonyl-1,4-diazepan-1-yl)ethanone
CID 138809140
2-[1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]piperidin-4-yl]acetic acid
CID 119178470
1-[(3R)-3-aminopyrrolidin-1-yl]-2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanone
CID 119411829
2-[(1R)-2,3-dihydro-1H-inden-1-yl]-1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]ethanone
CID 97154142
2-(2,3-dihydro-1H-inden-1-yl)-1-[4-(4-methylphenyl)-1,4-diazepan-1-yl]ethanone
CID 86955627
2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetate
CID 21310563
2-(2,3-dihydro-1H-inden-1-yl)-1-[4-(2,5-dimethylthiophen-3-yl)sulfonylpiperazin-1-yl]ethanone
CID 86955690
1-methyl-4-[[2-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetyl]amino]pyrrole-2-carboxamide
CID 95617018
2-(2,3-dihydro-1H-inden-1-yl)-1-(2-phenyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)ethanone
CID 72937112

Frequently Asked Questions

What is the IUPAC name of 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide (CID 97118952) is 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide is Cn1c(C(N)=O)cc2c1CN(C(=O)C[C@H]1CCc3ccccc31)CC2.
What is the InChIKey of 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The InChIKey is GQXBIYHTCZNAEE-CQSZACIVSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-22-17(20(21)25)10-15-8-9-23(12-18(15)22)19(24)11-14-7-6-13-4-2-3-5-16(13)14/h2-5,10,14H,6-9,11-12H2,1H3,(H2,21,25)/t14-/m1/s1.
What are the key properties of 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide?
6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[(1R)-2,3-dihydro-1H-inden-1-yl]acetyl]-1-methyl-5,7-dihydro-4H-pyrrolo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 97118952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).