1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide

C19H34N4O3 — CID 24790674

IUPAC1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCCN1CCCC1)C1CCC(=O)N(CCCN2CCOCC2)C1
InChIInChI=1S/C19H34N4O3/c24-18-5-4-17(19(25)20-6-11-21-7-1-2-8-21)16-23(18)10-3-9-22-12-14-26-15-13-22/h17H,1-16H2,(H,20,25)
InChIKeyZZUPTTBKWAQRPM-UHFFFAOYSA-N
MW366.51 g/mol
LogP0.16
Rot. Bonds8

About 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide

1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide (PubChem CID 24790674) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide
PubChem CID24790674
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC Name1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCCN1CCCC1)C1CCC(=O)N(CCCN2CCOCC2)C1
InChIInChI=1S/C19H34N4O3/c24-18-5-4-17(19(25)20-6-11-21-7-1-2-8-21)16-23(18)10-3-9-22-12-14-26-15-13-22/h17H,1-16H2,(H,20,25)
InChIKeyZZUPTTBKWAQRPM-UHFFFAOYSA-N
XLogP0.16
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide?
The IUPAC name of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide (CID 24790674) is 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide is O=C(NCCN1CCCC1)C1CCC(=O)N(CCCN2CCOCC2)C1.
What is the InChIKey of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide?
The InChIKey is ZZUPTTBKWAQRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c24-18-5-4-17(19(25)20-6-11-21-7-1-2-8-21)16-23(18)10-3-9-22-12-14-26-15-13-22/h17H,1-16H2,(H,20,25).
What are the key properties of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide?
1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide has a molecular weight of 366.51 g/mol, XLogP of 0.16, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 24790674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).