5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride

C14H24ClN3O2 — CID 119999589

IUPAC5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride
SMILESCl.O=C1CCC(C(=O)N2CCC(C3CCCN3)CC2)N1
InChIInChI=1S/C14H23N3O2.ClH/c18-13-4-3-12(16-13)14(19)17-8-5-10(6-9-17)11-2-1-7-15-11;/h10-12,15H,1-9H2,(H,16,18);1H
InChIKeyBLVBMINRABFZRG-UHFFFAOYSA-N
MW301.82 g/mol
LogP0.68
Rot. Bonds2

About 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride

5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride (PubChem CID 119999589) has the molecular formula C14H24ClN3O2 and a molecular weight of 301.82 g/mol. Its IUPAC name is 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride.

Molecular Properties

Compound Name5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride
PubChem CID119999589
Molecular FormulaC14H24ClN3O2
Molecular Weight301.82 g/mol
Exact Mass301.16
IUPAC Name5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride
SMILESCl.O=C1CCC(C(=O)N2CCC(C3CCCN3)CC2)N1
InChIInChI=1S/C14H23N3O2.ClH/c18-13-4-3-12(16-13)14(19)17-8-5-10(6-9-17)11-2-1-7-15-11;/h10-12,15H,1-9H2,(H,16,18);1H
InChIKeyBLVBMINRABFZRG-UHFFFAOYSA-N
XLogP0.68
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(5R)-5-(pyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 45116190
cyclopentyl-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 63259153
5-(4-aminopiperidine-1-carbonyl)pyrrolidin-2-one
CID 43556218
(4-pyrrolidin-2-ylpiperidin-1-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 66477511
6-[(2R)-piperidine-2-carbonyl]-1,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-2-one
CID 104914426
2-adamantyl-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 119999448
(2-iodophenyl)-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone;hydrochloride
CID 119999409
2-methoxy-1-(4-pyrrolidin-2-ylpiperidin-1-yl)ethanone;hydrochloride
CID 119999699
(5R)-5-(3-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 103806957
5-(4-methylsulfonylpiperidine-1-carbonyl)pyrrolidin-2-one
CID 90586478
(5-methyl-1H-pyrazol-4-yl)-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone;hydrochloride
CID 119999596
2-methyl-1-(4-pyrrolidin-2-ylpiperidin-1-yl)propan-1-one
CID 63259596

Frequently Asked Questions

What is the IUPAC name of 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
The IUPAC name of 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride (CID 119999589) is 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride.
What is the SMILES notation for 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
The canonical SMILES for 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride is Cl.O=C1CCC(C(=O)N2CCC(C3CCCN3)CC2)N1.
What is the InChIKey of 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
The InChIKey is BLVBMINRABFZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2.ClH/c18-13-4-3-12(16-13)14(19)17-8-5-10(6-9-17)11-2-1-7-15-11;/h10-12,15H,1-9H2,(H,16,18);1H.
What are the key properties of 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride?
5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride has a molecular weight of 301.82 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-pyrrolidin-2-ylpiperidine-1-carbonyl)pyrrolidin-2-one;hydrochloride is sourced from PubChem (CID 119999589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).