[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone

C15H19N3O2 — CID 3487323

IUPAC[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1ccc(C(=O)N2CCCC2)nc1)N1CCCC1
InChIInChI=1S/C15H19N3O2/c19-14(17-7-1-2-8-17)12-5-6-13(16-11-12)15(20)18-9-3-4-10-18/h5-6,11H,1-4,7-10H2
InChIKeyWIZSFPHVZBUOLI-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.55
Rot. Bonds2

About [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone

[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 3487323) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID3487323
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1ccc(C(=O)N2CCCC2)nc1)N1CCCC1
InChIInChI=1S/C15H19N3O2/c19-14(17-7-1-2-8-17)12-5-6-13(16-11-12)15(20)18-9-3-4-10-18/h5-6,11H,1-4,7-10H2
InChIKeyWIZSFPHVZBUOLI-UHFFFAOYSA-N
XLogP1.55
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-3-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 4155185
azepan-1-yl-(5-pyrrolidin-1-yl-2-pyridinyl)methanone
CID 109182048
[4-(azocane-1-carbonyl)phenyl]-(azocan-1-yl)methanone
CID 3317192
azepan-1-yl-(5-hydrazinyl-2-pyridinyl)methanone
CID 104642343
5-(4-hydroxypiperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 43414812
(6-methylsulfanyl-3-pyridinyl)-piperidin-1-ylmethanone
CID 142545270
5-(pyrrolidine-1-carbonyl)pyrazine-2-carboxylic acid
CID 117213082
[6-(1H-pyrazol-4-yl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 3931667
ethane;formic acid;(5-methyl-2-pyridinyl)-pyrrolidin-1-ylmethanone
CID 142369498
(2-methylpyrimidin-5-yl)-pyrrolidin-1-ylmethanone
CID 89084134
[6-[4-[di(thiophen-3-yl)methylidene]piperidine-1-carbonyl]-3-pyridinyl]-[4-[di(thiophen-3-yl)methylidene]piperidin-1-yl]methanone
CID 110184176
[2-(azepane-1-carbonyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109080392

Frequently Asked Questions

What is the IUPAC name of [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone (CID 3487323) is [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone is O=C(c1ccc(C(=O)N2CCCC2)nc1)N1CCCC1.
What is the InChIKey of [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is WIZSFPHVZBUOLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c19-14(17-7-1-2-8-17)12-5-6-13(16-11-12)15(20)18-9-3-4-10-18/h5-6,11H,1-4,7-10H2.
What are the key properties of [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone?
[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 273.34 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 3487323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).