N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide

C13H24N2O3 — CID 103274805

IUPACN-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide
SMILESCCOCC(NC(=O)C1CCC(=O)NC1)C(C)C
InChIInChI=1S/C13H24N2O3/c1-4-18-8-11(9(2)3)15-13(17)10-5-6-12(16)14-7-10/h9-11H,4-8H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyDWNYXPNHEUOZFZ-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.69
Rot. Bonds6

About N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide

N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide (PubChem CID 103274805) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide
PubChem CID103274805
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide
SMILESCCOCC(NC(=O)C1CCC(=O)NC1)C(C)C
InChIInChI=1S/C13H24N2O3/c1-4-18-8-11(9(2)3)15-13(17)10-5-6-12(16)14-7-10/h9-11H,4-8H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyDWNYXPNHEUOZFZ-UHFFFAOYSA-N
XLogP0.69
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-(1-ethoxy-3-methylbutan-2-yl)piperidine-3-carboxamide
CID 114113782
N-(3-ethylpentan-2-yl)-6-oxopiperidine-3-carboxamide
CID 78952778
(2S,3S)-3-methyl-2-[[(3R)-6-oxopiperidine-3-carbonyl]amino]pentanoic acid
CID 129380712
N-(4-hydroxy-1-methoxybutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 103850894
N-(2-ethoxypropyl)-6-oxopiperidine-3-carboxamide
CID 115649057
N-(1-methylsulfanylbutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 115900350
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-6-oxopiperidine-3-carboxamide
CID 113408101
(2S)-5-ethoxy-5-oxo-2-[(6-oxopiperidine-3-carbonyl)amino]pentanoic acid
CID 107039270
N-[(2R)-2-hydroxypropyl]-6-oxopiperidine-3-carboxamide
CID 103884751
2-methyl-3-[(6-oxopiperidine-3-carbonyl)amino]propanoic acid
CID 83192791
N-[3-(dimethylamino)-3-oxopropyl]-6-oxopiperidine-3-carboxamide
CID 112728984
6-oxo-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 71652098

Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide (CID 103274805) is N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide is CCOCC(NC(=O)C1CCC(=O)NC1)C(C)C.
What is the InChIKey of N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide?
The InChIKey is DWNYXPNHEUOZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-4-18-8-11(9(2)3)15-13(17)10-5-6-12(16)14-7-10/h9-11H,4-8H2,1-3H3,(H,14,16)(H,15,17).
What are the key properties of N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide?
N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxy-3-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 103274805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).