N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide

C15H27N3O2 — CID 42542173

IUPACN-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CC(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-12-3-9-18(10-4-12)14(19)11-17-7-5-13(6-8-17)15(20)16-2/h12-13H,3-11H2,1-2H3,(H,16,20)
InChIKeyJAOAROVEMRWOOH-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.70
Rot. Bonds3

About N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide

N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide (PubChem CID 42542173) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide
PubChem CID42542173
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CC(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-12-3-9-18(10-4-12)14(19)11-17-7-5-13(6-8-17)15(20)16-2/h12-13H,3-11H2,1-2H3,(H,16,20)
InChIKeyJAOAROVEMRWOOH-UHFFFAOYSA-N
XLogP0.70
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 39903910
ethane;1-[4-(1-hydroxyethenyl)piperidin-1-yl]-2-(4-methylpiperidin-1-yl)ethanone
CID 142372781
N-methyl-1-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidine-4-carboxamide
CID 42542254
2-[4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]acetic acid
CID 43521829
1-(4-ethylpiperazin-1-yl)-2-(4-methylpiperidin-1-yl)ethanone
CID 59555423
N-methyl-1-(3-methyl-2-oxobutyl)piperidine-4-carboxamide
CID 79396383
1-[2-(4-aminopiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63578248
N-cyclopropyl-2-[4-[2-(4-methylpiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
CID 78822225
1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63571418
1-(4-methylpiperidin-1-yl)-3-pyrrolidin-1-ylpropane-1,3-dione
CID 108941930
1-(4-methylpiperidin-1-yl)-2-(4-methylsulfonylpiperazin-1-yl)ethanone
CID 110684423
2-(4-acetyl-1,4-diazepan-1-yl)-1-(4-methylpiperidin-1-yl)ethanone
CID 127883264

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide?
The IUPAC name of N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide (CID 42542173) is N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide?
The canonical SMILES for N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide is CNC(=O)C1CCN(CC(=O)N2CCC(C)CC2)CC1.
What is the InChIKey of N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide?
The InChIKey is JAOAROVEMRWOOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-12-3-9-18(10-4-12)14(19)11-17-7-5-13(6-8-17)15(20)16-2/h12-13H,3-11H2,1-2H3,(H,16,20).
What are the key properties of N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide?
N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide is sourced from PubChem (CID 42542173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).