1-N,1-N-diethylpiperidine-1,2-dicarboxamide

C11H21N3O2 — CID 115583146

IUPAC1-N,1-N-diethylpiperidine-1,2-dicarboxamide
SMILESCCN(CC)C(=O)N1CCCCC1C(N)=O
InChIInChI=1S/C11H21N3O2/c1-3-13(4-2)11(16)14-8-6-5-7-9(14)10(12)15/h9H,3-8H2,1-2H3,(H2,12,15)
InChIKeyVWMKSBBSUUTYRN-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.79
Rot. Bonds3

About 1-N,1-N-diethylpiperidine-1,2-dicarboxamide

1-N,1-N-diethylpiperidine-1,2-dicarboxamide (PubChem CID 115583146) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-N,1-N-diethylpiperidine-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N-diethylpiperidine-1,2-dicarboxamide
PubChem CID115583146
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name1-N,1-N-diethylpiperidine-1,2-dicarboxamide
SMILESCCN(CC)C(=O)N1CCCCC1C(N)=O
InChIInChI=1S/C11H21N3O2/c1-3-13(4-2)11(16)14-8-6-5-7-9(14)10(12)15/h9H,3-8H2,1-2H3,(H2,12,15)
InChIKeyVWMKSBBSUUTYRN-UHFFFAOYSA-N
XLogP0.79
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-carbamoylpiperidine-1-carbonyl)-(carboxymethyl)amino]acetic acid
CID 63645478
1-propanoylpiperidine-2-carboxamide
CID 60717244
1-(2-methylpropanoyl)piperidine-2-carboxamide
CID 60717227
(2S)-1-[(2S)-2-hydroxypropanoyl]piperidine-2-carboxamide
CID 173098418
(2R)-1-propanoylpyrrolidine-2-carboxamide
CID 92979578
(2S)-1-[ethyl(propyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61195285
1-(2-bromobutanoyl)piperidine-2-carboxamide
CID 62854478
1-[2-ethoxyethyl(ethyl)carbamoyl]piperidine-2-carboxylic acid
CID 55228473
1-[benzyl(ethyl)carbamoyl]piperidine-2-carboxylic acid
CID 61185364
N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
CID 71910820
3-(2-carbamoylpiperidin-1-yl)-2-methyl-3-oxopropanoic acid
CID 114897445
1-(3-methyl-2-sulfanylbutanoyl)piperidine-2-carboxamide
CID 107026089

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-diethylpiperidine-1,2-dicarboxamide?
The IUPAC name of 1-N,1-N-diethylpiperidine-1,2-dicarboxamide (CID 115583146) is 1-N,1-N-diethylpiperidine-1,2-dicarboxamide.
What is the SMILES notation for 1-N,1-N-diethylpiperidine-1,2-dicarboxamide?
The canonical SMILES for 1-N,1-N-diethylpiperidine-1,2-dicarboxamide is CCN(CC)C(=O)N1CCCCC1C(N)=O.
What is the InChIKey of 1-N,1-N-diethylpiperidine-1,2-dicarboxamide?
The InChIKey is VWMKSBBSUUTYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-3-13(4-2)11(16)14-8-6-5-7-9(14)10(12)15/h9H,3-8H2,1-2H3,(H2,12,15).
What are the key properties of 1-N,1-N-diethylpiperidine-1,2-dicarboxamide?
1-N,1-N-diethylpiperidine-1,2-dicarboxamide has a molecular weight of 227.31 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-diethylpiperidine-1,2-dicarboxamide is sourced from PubChem (CID 115583146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).