N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide

C14H28N2O2 — CID 176985091

IUPACN-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide
SMILESCCCCOCCNC(=O)C1CCN(CC)CC1
InChIInChI=1S/C14H28N2O2/c1-3-5-11-18-12-8-15-14(17)13-6-9-16(4-2)10-7-13/h13H,3-12H2,1-2H3,(H,15,17)
InChIKeyXWVDDLFXVPNFHC-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.65
Rot. Bonds8

About N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide

N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide (PubChem CID 176985091) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide
PubChem CID176985091
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide
SMILESCCCCOCCNC(=O)C1CCN(CC)CC1
InChIInChI=1S/C14H28N2O2/c1-3-5-11-18-12-8-15-14(17)13-6-9-16(4-2)10-7-13/h13H,3-12H2,1-2H3,(H,15,17)
InChIKeyXWVDDLFXVPNFHC-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

ethane;1-methyl-N-[2-[2-(methylamino)ethoxy]ethyl]piperidine-4-carboxamide
CID 177054985
1-butyl-N-propylpiperidine-4-carboxamide
CID 155706109
1-butyl-N-(2-hydroxyethyl)piperidine-4-carboxamide
CID 54039617
ethane;N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-methylcyclohexane-1-carboxamide
CID 177357452
N-butyl-1-formylpiperidine-4-carboxamide
CID 64992513
1-[2-(butylcarbamoylamino)-2-oxoethyl]-N-(3-methoxypropyl)piperidine-4-carboxamide
CID 55911947
N-[2-(2-aminoethoxy)ethyl]-4-butylcyclohexane-1-carboxamide
CID 63754103
N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide
CID 60500354
2-(2-butoxyethylcarbamoyl)cyclopropane-1-carboxylic acid
CID 61171060
methyl 1-(2-butoxyethyl)piperidine-4-carboxylate
CID 61067326
1-(3-hydroxypropyl)-N-propylpiperidine-4-carboxamide
CID 110884748
1-butylsulfonyl-N-[3-(4-ethylpiperazin-1-yl)propyl]piperidine-4-carboxamide
CID 60559721

Frequently Asked Questions

What is the IUPAC name of N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide?
The IUPAC name of N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide (CID 176985091) is N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide is CCCCOCCNC(=O)C1CCN(CC)CC1.
What is the InChIKey of N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide?
The InChIKey is XWVDDLFXVPNFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-5-11-18-12-8-15-14(17)13-6-9-16(4-2)10-7-13/h13H,3-12H2,1-2H3,(H,15,17).
What are the key properties of N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide?
N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 1.65, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide is sourced from PubChem (CID 176985091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).