N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide

C17H24N2O3 — CID 51100226

IUPACN,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide
SMILESCCN(CC)C(=O)C1CCN(C(=O)c2ccccc2O)CC1
InChIInChI=1S/C17H24N2O3/c1-3-18(4-2)16(21)13-9-11-19(12-10-13)17(22)14-7-5-6-8-15(14)20/h5-8,13,20H,3-4,9-12H2,1-2H3
InChIKeyFMILVUWKVZWTQR-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.11
Rot. Bonds4

About N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide

N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide (PubChem CID 51100226) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide
PubChem CID51100226
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide
SMILESCCN(CC)C(=O)C1CCN(C(=O)c2ccccc2O)CC1
InChIInChI=1S/C17H24N2O3/c1-3-18(4-2)16(21)13-9-11-19(12-10-13)17(22)14-7-5-6-8-15(14)20/h5-8,13,20H,3-4,9-12H2,1-2H3
InChIKeyFMILVUWKVZWTQR-UHFFFAOYSA-N
XLogP2.11
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 10252
Edasalonexent
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N,N'-1,2-Ethanediylbis(2-hydroxybenzamide)
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CID 209651
Salicylic acid ethanolamide
CID 90407
2-Hydroxy-N,N-dimethylbenzamide
CID 74500
N-Methylsalicylamide
CID 74624
4-Salicyloylmorpholine
CID 229478
Methylol salicylamide
CID 95698
N,N'-1,3-Propanediylbis(2-hydroxybenzamide)
CID 212503
N-Benzyl-2-hydroxybenzamide
CID 561227
US9676786, example 6
CID 118195533

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide?
The IUPAC name of N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide (CID 51100226) is N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide is CCN(CC)C(=O)C1CCN(C(=O)c2ccccc2O)CC1.
What is the InChIKey of N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide?
The InChIKey is FMILVUWKVZWTQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-3-18(4-2)16(21)13-9-11-19(12-10-13)17(22)14-7-5-6-8-15(14)20/h5-8,13,20H,3-4,9-12H2,1-2H3.
What are the key properties of N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide?
N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(2-hydroxybenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 51100226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).