[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone

C18H19N3O — CID 109203702

IUPAC[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cc(N2CCc3ccccc32)ccn1)N1CCCC1
InChIInChI=1S/C18H19N3O/c22-18(20-10-3-4-11-20)16-13-15(7-9-19-16)21-12-8-14-5-1-2-6-17(14)21/h1-2,5-7,9,13H,3-4,8,10-12H2
InChIKeySDEHWNHKHBHOTA-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.01
Rot. Bonds2

About [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone

[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 109203702) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID109203702
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cc(N2CCc3ccccc32)ccn1)N1CCCC1
InChIInChI=1S/C18H19N3O/c22-18(20-10-3-4-11-20)16-13-15(7-9-19-16)21-12-8-14-5-1-2-6-17(14)21/h1-2,5-7,9,13H,3-4,8,10-12H2
InChIKeySDEHWNHKHBHOTA-UHFFFAOYSA-N
XLogP3.01
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203703
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109204447
[2-(azepane-1-carbonyl)-4-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109090729
pyrrolidin-1-yl-(4-pyrrolidin-1-yl-2-pyridinyl)methanone
CID 10776780
[6-(3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109341707
N-butan-2-yl-4-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109203323
4-(3,4-dihydro-2H-quinolin-1-yl)-N-phenylpyridine-2-carboxamide
CID 109218742
(4-piperidin-1-yl-2-pyridinyl)-pyrrolidin-1-ylmethanone
CID 109203615
piperidin-1-yl-(4-pyrrolidin-1-yl-2-pyridinyl)methanone
CID 109203804
N-cyclopentyl-4-(3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carboxamide
CID 109204075
4-(2,3-dihydroindol-1-yl)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 109219625
4-(2,3-dihydroindol-1-yl)-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide
CID 109210448

Frequently Asked Questions

What is the IUPAC name of [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone (CID 109203702) is [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone is O=C(c1cc(N2CCc3ccccc32)ccn1)N1CCCC1.
What is the InChIKey of [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is SDEHWNHKHBHOTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c22-18(20-10-3-4-11-20)16-13-15(7-9-19-16)21-12-8-14-5-1-2-6-17(14)21/h1-2,5-7,9,13H,3-4,8,10-12H2.
What are the key properties of [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone?
[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 293.37 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 109203702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).