7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one

C17H17N3O — CID 154768125

IUPAC7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cccc(-c3ccc(N4CCCC4)nc3)c2N1
InChIInChI=1S/C17H17N3O/c21-16-10-12-4-3-5-14(17(12)19-16)13-6-7-15(18-11-13)20-8-1-2-9-20/h3-7,11H,1-2,8-10H2,(H,19,21)
InChIKeyDDURVGJLLVGWOD-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.84
Rot. Bonds2

About 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one

7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one (PubChem CID 154768125) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one
PubChem CID154768125
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cccc(-c3ccc(N4CCCC4)nc3)c2N1
InChIInChI=1S/C17H17N3O/c21-16-10-12-4-3-5-14(17(12)19-16)13-6-7-15(18-11-13)20-8-1-2-9-20/h3-7,11H,1-2,8-10H2,(H,19,21)
InChIKeyDDURVGJLLVGWOD-UHFFFAOYSA-N
XLogP2.84
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(6-piperidin-1-yl-3-pyridinyl)aniline
CID 82119925
7-(2-hydroxypropan-2-yl)-1,3-dihydroindol-2-one
CID 117282362
4-(6-morpholin-4-yl-3-pyridinyl)-2,3-dihydroisoindol-1-one
CID 175996415
6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one
CID 177382697
6-piperidin-1-ylpyridine-3-carboxylic acid
CID 2794761
3-[6-(azepan-1-yl)-3-pyridinyl]-N,N-dimethylbenzamide
CID 53150002
(6-piperidin-1-yl-3-pyridinyl)sulfonylmethanol
CID 58327638
4-(5-phenyl-2-pyridinyl)piperazine-1-carboxylic acid
CID 68644218
2-aminosulfanyl-N'-hydrazinyl-6-(6-piperidin-1-yl-3-pyridinyl)benzenecarboximidamide
CID 144893559
1-methyl-4-[[4-(6-pyrrolidin-1-yl-3-pyridinyl)phenyl]methyl]piperazine
CID 146252821
1-[1-(3-methyl-1H-inden-2-yl)ethyl]-3-(6-pyrrolidin-1-yl-3-pyridinyl)urea
CID 166532937
5-(6-piperazin-1-yl-3-pyridinyl)-1,3-dihydroinden-2-one
CID 159120939

Frequently Asked Questions

What is the IUPAC name of 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one (CID 154768125) is 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one is O=C1Cc2cccc(-c3ccc(N4CCCC4)nc3)c2N1.
What is the InChIKey of 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one?
The InChIKey is DDURVGJLLVGWOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c21-16-10-12-4-3-5-14(17(12)19-16)13-6-7-15(18-11-13)20-8-1-2-9-20/h3-7,11H,1-2,8-10H2,(H,19,21).
What are the key properties of 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one?
7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one has a molecular weight of 279.34 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-pyrrolidin-1-yl-3-pyridinyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 154768125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).