2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone

C15H20N2O — CID 93394367

IUPAC2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone
SMILESCC[C@H]1CCCN1C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H20N2O/c1-2-13-4-3-9-17(13)15(18)12-5-6-14-11(10-12)7-8-16-14/h5-6,10,13,16H,2-4,7-9H2,1H3/t13-/m0/s1
InChIKeyZYIUZCOMFJNEOB-ZDUSSCGKSA-N
MW244.34 g/mol
LogP2.67
Rot. Bonds2

About 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone

2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone (PubChem CID 93394367) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone
PubChem CID93394367
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone
SMILESCC[C@H]1CCCN1C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H20N2O/c1-2-13-4-3-9-17(13)15(18)12-5-6-14-11(10-12)7-8-16-14/h5-6,10,13,16H,2-4,7-9H2,1H3/t13-/m0/s1
InChIKeyZYIUZCOMFJNEOB-ZDUSSCGKSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dihydro-1H-indol-5-yl-(2-ethylpyrrolidin-1-yl)methanone
CID 54886081
(2-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 83052849
1-(2,3-dihydro-1H-indole-5-carbonyl)pyrrolidine-2-carboxylic acid
CID 61157126
[(2R)-2-[(2-ethylimidazol-1-yl)methyl]pyrrolidin-1-yl]-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 138057219
1-(2,3-dihydro-1H-indole-5-carbonyl)piperidine-2-carboxamide
CID 60937223
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
1-[4-(2,3-dihydro-1H-indole-5-carbonyl)piperazin-1-yl]ethanone
CID 60893291
(2-ethylpyrrolidin-1-yl)-pyridin-4-ylmethanone
CID 84514744
2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone
CID 43142508
(3-aminophenyl)-(2-ethylpyrrolidin-1-yl)methanone
CID 60973373
N-[1-(2,3-dihydro-1H-indole-5-carbonyl)piperidin-3-yl]acetamide
CID 60947810
4-(2,3-dihydro-1H-indole-5-carbonyl)-3-ethylpiperazine-2,6-dione
CID 66069532

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone?
The IUPAC name of 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone (CID 93394367) is 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone.
What is the SMILES notation for 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone?
The canonical SMILES for 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone is CC[C@H]1CCCN1C(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone?
The InChIKey is ZYIUZCOMFJNEOB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H20N2O/c1-2-13-4-3-9-17(13)15(18)12-5-6-14-11(10-12)7-8-16-14/h5-6,10,13,16H,2-4,7-9H2,1H3/t13-/m0/s1.
What are the key properties of 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone?
2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone has a molecular weight of 244.34 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone is sourced from PubChem (CID 93394367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).