1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide

C19H26N4O3 — CID 9397024

IUPAC1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)CC1
InChIInChI=1S/C19H26N4O3/c20-17(24)14-6-10-22(11-7-14)18(25)15-8-12-23(13-9-15)19(26)21-16-4-2-1-3-5-16/h1-5,14-15H,6-13H2,(H2,20,24)(H,21,26)
InChIKeyJZHJZXCNHGJCKQ-UHFFFAOYSA-N
MW358.44 g/mol
LogP1.65
Rot. Bonds3

About 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide

1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide (PubChem CID 9397024) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide
PubChem CID9397024
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)CC1
InChIInChI=1S/C19H26N4O3/c20-17(24)14-6-10-22(11-7-14)18(25)15-8-12-23(13-9-15)19(26)21-16-4-2-1-3-5-16/h1-5,14-15H,6-13H2,(H2,20,24)(H,21,26)
InChIKeyJZHJZXCNHGJCKQ-UHFFFAOYSA-N
XLogP1.65
TPSA95.74 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide?
The IUPAC name of 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide (CID 9397024) is 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)CC1.
What is the InChIKey of 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide?
The InChIKey is JZHJZXCNHGJCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c20-17(24)14-6-10-22(11-7-14)18(25)15-8-12-23(13-9-15)19(26)21-16-4-2-1-3-5-16/h1-5,14-15H,6-13H2,(H2,20,24)(H,21,26).
What are the key properties of 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide?
1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(phenylcarbamoyl)piperidine-4-carbonyl]piperidine-4-carboxamide is sourced from PubChem (CID 9397024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).