[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone

C18H18ClN3O — CID 172902056

IUPAC[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(C1CCN(c2ccc(Cl)cn2)C1)N1CCc2ccccc21
InChIInChI=1S/C18H18ClN3O/c19-15-5-6-17(20-11-15)21-9-7-14(12-21)18(23)22-10-8-13-3-1-2-4-16(13)22/h1-6,11,14H,7-10,12H2
InChIKeyNKZJIFAUQAAMLT-UHFFFAOYSA-N
MW327.81 g/mol
LogP3.15
Rot. Bonds2

About [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone

[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone (PubChem CID 172902056) has the molecular formula C18H18ClN3O and a molecular weight of 327.81 g/mol. Its IUPAC name is [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone
PubChem CID172902056
Molecular FormulaC18H18ClN3O
Molecular Weight327.81 g/mol
Exact Mass327.11
IUPAC Name[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(C1CCN(c2ccc(Cl)cn2)C1)N1CCc2ccccc21
InChIInChI=1S/C18H18ClN3O/c19-15-5-6-17(20-11-15)21-9-7-14(12-21)18(23)22-10-8-13-3-1-2-4-16(13)22/h1-6,11,14H,7-10,12H2
InChIKeyNKZJIFAUQAAMLT-UHFFFAOYSA-N
XLogP3.15
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.81
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone 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

2,3-dihydroindol-1-yl-[1-(5-fluoro-2-pyridinyl)pyrrolidin-3-yl]methanone
CID 172901641
[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]-(2,3-dihydroindol-1-yl)methanone
CID 172891749
[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-pyrrolidin-1-ylmethanone
CID 166602453
[1-(3-chloro-2-pyridinyl)piperidin-4-yl]-(2,3-dihydroindol-1-yl)methanone
CID 172902388
2,3-dihydroindol-1-yl-[1-(5,6-dimethylpyridazin-3-yl)pyrrolidin-3-yl]methanone
CID 172901325
2,3-dihydroindol-1-yl-[1-(1,3-thiazol-2-yl)pyrrolidin-3-yl]methanone
CID 172901505
2,3-dihydroindol-1-yl-[1-(6-piperidin-1-ylpyrimidin-4-yl)piperidin-4-yl]methanone
CID 133298996
[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(4,4-difluoropiperidin-1-yl)methanone
CID 165434726
2,3-dihydroindol-1-yl-[1-(7H-purin-6-yl)pyrrolidin-3-yl]methanone
CID 172903825
cyclopropyl-[4-(2,3-dihydroindole-1-carbonyl)piperidin-1-yl]methanone
CID 26290467
[1-(5-chloro-2-pyridinyl)piperidin-4-yl]-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 38982023
2-chloro-4-[4-(2,3-dihydroindole-1-carbonyl)piperidin-1-yl]benzonitrile
CID 133298993

Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone (CID 172902056) is [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone is O=C(C1CCN(c2ccc(Cl)cn2)C1)N1CCc2ccccc21.
What is the InChIKey of [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is NKZJIFAUQAAMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O/c19-15-5-6-17(20-11-15)21-9-7-14(12-21)18(23)22-10-8-13-3-1-2-4-16(13)22/h1-6,11,14H,7-10,12H2.
What are the key properties of [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone?
[1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 327.81 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloro-2-pyridinyl)pyrrolidin-3-yl]-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 172902056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).