1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide

C16H28N4O3 — CID 714447

IUPAC1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide
SMILESNC(=O)C1(N2CCCCC2)CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C16H28N4O3/c17-14(21)16(20-6-2-1-3-7-20)4-8-18(9-5-16)15(22)19-10-12-23-13-11-19/h1-13H2,(H2,17,21)
InChIKeyKPCMNOVJNLZPMD-UHFFFAOYSA-N
MW324.43 g/mol
LogP0.24
Rot. Bonds2

About 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide

1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide (PubChem CID 714447) has the molecular formula C16H28N4O3 and a molecular weight of 324.43 g/mol. Its IUPAC name is 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide
PubChem CID714447
Molecular FormulaC16H28N4O3
Molecular Weight324.43 g/mol
Exact Mass324.22
IUPAC Name1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide
SMILESNC(=O)C1(N2CCCCC2)CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C16H28N4O3/c17-14(21)16(20-6-2-1-3-7-20)4-8-18(9-5-16)15(22)19-10-12-23-13-11-19/h1-13H2,(H2,17,21)
InChIKeyKPCMNOVJNLZPMD-UHFFFAOYSA-N
XLogP0.24
TPSA79.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide (CID 714447) is 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide is NC(=O)C1(N2CCCCC2)CCN(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide?
The InChIKey is KPCMNOVJNLZPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O3/c17-14(21)16(20-6-2-1-3-7-20)4-8-18(9-5-16)15(22)19-10-12-23-13-11-19/h1-13H2,(H2,17,21).
What are the key properties of 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide?
1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(morpholine-4-carbonyl)-4-piperidin-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 714447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).