2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone

C15H20N2O — CID 63217542

IUPAC2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone
SMILESCC1(C)CCCN1C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H20N2O/c1-15(2)7-3-9-17(15)14(18)12-4-5-13-11(10-12)6-8-16-13/h4-5,10,16H,3,6-9H2,1-2H3
InChIKeyJUYGZSYOVHGOPI-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.67
Rot. Bonds1

About 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone

2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone (PubChem CID 63217542) 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-(2,2-dimethylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone
PubChem CID63217542
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone
SMILESCC1(C)CCCN1C(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H20N2O/c1-15(2)7-3-9-17(15)14(18)12-4-5-13-11(10-12)6-8-16-13/h4-5,10,16H,3,6-9H2,1-2H3
InChIKeyJUYGZSYOVHGOPI-UHFFFAOYSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
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

4-(2,3-dihydro-1H-indole-5-carbonyl)-3,3-dimethylpiperazine-2,6-dione
CID 66075589
1-[4-(2,3-dihydro-1H-indole-5-carbonyl)piperazin-1-yl]ethanone
CID 60893291
3,3-dimethyl-4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)piperazin-2-one
CID 63606548
(2,2-dimethylpyrrolidin-1-yl)-(4-hydroxyphenyl)methanone
CID 63218627
2,3-dihydro-1H-indol-5-yl-(2,6-dimethylpiperidin-1-yl)methanone
CID 43142508
1-(2,3-dihydro-1H-indol-5-yl)ethanone
CID 170999934
4-(2,2-dimethylpyrrolidine-1-carbonyl)pyridine-2-carboxylic acid
CID 113263155
2,3-dihydro-1H-indol-5-yl-(2-ethylpyrrolidin-1-yl)methanone
CID 54886081
2,3-dihydro-1H-indol-5-yl-[(2S)-2-ethylpyrrolidin-1-yl]methanone
CID 93394367
4-(2,3-dihydro-1H-indole-5-carbonyl)-3-methylpiperazin-2-one
CID 63606218
1-(2,3-dihydro-1H-indole-5-carbonyl)pyrrolidine-2-carboxylic acid
CID 61157126
2,3-dihydro-1H-indol-6-yl-(3-methoxy-3-methylpiperidin-1-yl)methanone
CID 107392419

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone (CID 63217542) is 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone is CC1(C)CCCN1C(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone?
The InChIKey is JUYGZSYOVHGOPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-15(2)7-3-9-17(15)14(18)12-4-5-13-11(10-12)6-8-16-13/h4-5,10,16H,3,6-9H2,1-2H3.
What are the key properties of 2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone?
2,3-dihydro-1H-indol-5-yl-(2,2-dimethylpyrrolidin-1-yl)methanone has a molecular weight of 244.34 g/mol, XLogP of 2.67, 1 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-(2,2-dimethylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 63217542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).