5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride

C17H32ClN3O2 — CID 119556333

IUPAC5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCCC(CC)N1CC(C(=O)NCCC2CCCNC2)CC1=O.Cl
InChIInChI=1S/C17H31N3O2.ClH/c1-3-15(4-2)20-12-14(10-16(20)21)17(22)19-9-7-13-6-5-8-18-11-13;/h13-15,18H,3-12H2,1-2H3,(H,19,22);1H
InChIKeySWENOVPHFINPPD-UHFFFAOYSA-N
MW345.92 g/mol
LogP1.95
Rot. Bonds7

About 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride

5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 119556333) has the molecular formula C17H32ClN3O2 and a molecular weight of 345.92 g/mol. Its IUPAC name is 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID119556333
Molecular FormulaC17H32ClN3O2
Molecular Weight345.92 g/mol
Exact Mass345.22
IUPAC Name5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCCC(CC)N1CC(C(=O)NCCC2CCCNC2)CC1=O.Cl
InChIInChI=1S/C17H31N3O2.ClH/c1-3-15(4-2)20-12-14(10-16(20)21)17(22)19-9-7-13-6-5-8-18-11-13;/h13-15,18H,3-12H2,1-2H3,(H,19,22);1H
InChIKeySWENOVPHFINPPD-UHFFFAOYSA-N
XLogP1.95
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.92
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-oxo-1-(1-phenylethyl)-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119554911
5-oxo-1-pentan-3-yl-N-pyrrolidin-3-ylpyrrolidine-3-carboxamide;hydrochloride
CID 119450895
1-(2-methoxyethyl)-5-oxo-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119555111
1-(3,5-dichlorophenyl)-5-oxo-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119559499
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
N-[2-(ethylamino)ethyl]-5-oxo-1-pentan-3-ylpyrrolidine-3-carboxamide
CID 119506044
1-naphthalen-1-yl-5-oxo-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide
CID 119555623
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
1-[(1-ethylpyrrolidin-2-yl)methyl]-5-oxo-N-(2-pyrrolidin-3-ylethyl)pyrrolidine-3-carboxamide;dihydrochloride
CID 119534166
3-methyl-2-(2-oxopyrrolidin-1-yl)-N-(2-piperidin-3-ylethyl)butanamide;hydrochloride
CID 119558817
1-(5-chloro-2-methoxyphenyl)-5-oxo-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide
CID 119556384
1-acetyl-N-(2-piperidin-3-ylethyl)piperidine-3-carboxamide
CID 119555744

Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride (CID 119556333) is 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride is CCC(CC)N1CC(C(=O)NCCC2CCCNC2)CC1=O.Cl.
What is the InChIKey of 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is SWENOVPHFINPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3O2.ClH/c1-3-15(4-2)20-12-14(10-16(20)21)17(22)19-9-7-13-6-5-8-18-11-13;/h13-15,18H,3-12H2,1-2H3,(H,19,22);1H.
What are the key properties of 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride?
5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 345.92 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-pentan-3-yl-N-(2-piperidin-3-ylethyl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119556333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).