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

C18H29N5O3 — CID 72924482

IUPAC1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCCn1cccn1)C1CCC(=O)N(CCCN2CCOCC2)C1
InChIInChI=1S/C18H29N5O3/c24-17-4-3-16(18(25)19-6-10-23-9-1-5-20-23)15-22(17)8-2-7-21-11-13-26-14-12-21/h1,5,9,16H,2-4,6-8,10-15H2,(H,19,25)
InChIKeySVVPBTMSGLAOCM-UHFFFAOYSA-N
MW363.46 g/mol
LogP-0.04
Rot. Bonds8

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

1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide (PubChem CID 72924482) has the molecular formula C18H29N5O3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide
PubChem CID72924482
Molecular FormulaC18H29N5O3
Molecular Weight363.46 g/mol
Exact Mass363.23
IUPAC Name1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCCn1cccn1)C1CCC(=O)N(CCCN2CCOCC2)C1
InChIInChI=1S/C18H29N5O3/c24-17-4-3-16(18(25)19-6-10-23-9-1-5-20-23)15-22(17)8-2-7-21-11-13-26-14-12-21/h1,5,9,16H,2-4,6-8,10-15H2,(H,19,25)
InChIKeySVVPBTMSGLAOCM-UHFFFAOYSA-N
XLogP-0.04
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide?
The IUPAC name of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide (CID 72924482) is 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide is O=C(NCCn1cccn1)C1CCC(=O)N(CCCN2CCOCC2)C1.
What is the InChIKey of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide?
The InChIKey is SVVPBTMSGLAOCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N5O3/c24-17-4-3-16(18(25)19-6-10-23-9-1-5-20-23)15-22(17)8-2-7-21-11-13-26-14-12-21/h1,5,9,16H,2-4,6-8,10-15H2,(H,19,25).
What are the key properties of 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide?
1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide has a molecular weight of 363.46 g/mol, XLogP of -0.04, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropyl)-6-oxo-N-(2-pyrazol-1-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 72924482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).