N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide

C19H33N3O2 — CID 3237241

IUPACN-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide
SMILESO=C(NCC(=O)N1CCC(N2CCCCC2)CC1)C1CCCCC1
InChIInChI=1S/C19H33N3O2/c23-18(15-20-19(24)16-7-3-1-4-8-16)22-13-9-17(10-14-22)21-11-5-2-6-12-21/h16-17H,1-15H2,(H,20,24)
InChIKeyMZFYTSHAKNPBIR-UHFFFAOYSA-N
MW335.49 g/mol
LogP2.16
Rot. Bonds4

About N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide

N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide (PubChem CID 3237241) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide
PubChem CID3237241
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC NameN-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide
SMILESO=C(NCC(=O)N1CCC(N2CCCCC2)CC1)C1CCCCC1
InChIInChI=1S/C19H33N3O2/c23-18(15-20-19(24)16-7-3-1-4-8-16)22-13-9-17(10-14-22)21-11-5-2-6-12-21/h16-17H,1-15H2,(H,20,24)
InChIKeyMZFYTSHAKNPBIR-UHFFFAOYSA-N
XLogP2.16
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide (CID 3237241) is N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide is O=C(NCC(=O)N1CCC(N2CCCCC2)CC1)C1CCCCC1.
What is the InChIKey of N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide?
The InChIKey is MZFYTSHAKNPBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2/c23-18(15-20-19(24)16-7-3-1-4-8-16)22-13-9-17(10-14-22)21-11-5-2-6-12-21/h16-17H,1-15H2,(H,20,24).
What are the key properties of N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide?
N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide has a molecular weight of 335.49 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 3237241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).