4-ethyl-N-octylpiperidine-4-carboxamide

C16H32N2O — CID 115567946

IUPAC4-ethyl-N-octylpiperidine-4-carboxamide
SMILESCCCCCCCCNC(=O)C1(CC)CCNCC1
InChIInChI=1S/C16H32N2O/c1-3-5-6-7-8-9-12-18-15(19)16(4-2)10-13-17-14-11-16/h17H,3-14H2,1-2H3,(H,18,19)
InChIKeyNSTGCOKSHNQGBI-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.24
Rot. Bonds9

About 4-ethyl-N-octylpiperidine-4-carboxamide

4-ethyl-N-octylpiperidine-4-carboxamide (PubChem CID 115567946) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 4-ethyl-N-octylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-octylpiperidine-4-carboxamide
PubChem CID115567946
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name4-ethyl-N-octylpiperidine-4-carboxamide
SMILESCCCCCCCCNC(=O)C1(CC)CCNCC1
InChIInChI=1S/C16H32N2O/c1-3-5-6-7-8-9-12-18-15(19)16(4-2)10-13-17-14-11-16/h17H,3-14H2,1-2H3,(H,18,19)
InChIKeyNSTGCOKSHNQGBI-UHFFFAOYSA-N
XLogP3.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-ethyl-N-octylpyrrolidine-3-carboxamide
CID 115567862
N-butyl-1-ethylcyclopropane-1-carboxamide;ethane
CID 171795822
N-(3-cyclohexyloxypropyl)-4-ethylpiperidine-4-carboxamide
CID 63128684
4-methoxy-N-pentylpiperidine-4-carboxamide
CID 119669674
2-[(4-ethylpiperidine-4-carbonyl)amino]ethyl carbamate
CID 83211105
1-(4-ethylpiperidin-4-yl)octan-1-one
CID 116567975
N-(4-amino-4-oxobutyl)-3-ethylpyrrolidine-3-carboxamide
CID 63139989
aziridine;octadecylcarbamic acid
CID 88639919
1-ethyl-N-(5-hydroxypentyl)cyclopentane-1-carboxamide
CID 107318578
3-ethyl-N-(3-pyrrolidin-1-ylpropyl)pyrrolidine-3-carboxamide
CID 55165904
N-[2-(4-chlorophenyl)ethyl]-4-ethylpiperidine-4-carboxamide
CID 63129179
3-ethyl-N-(4-hydroxypentyl)pyrrolidine-3-carboxamide
CID 106134765

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-octylpiperidine-4-carboxamide?
The IUPAC name of 4-ethyl-N-octylpiperidine-4-carboxamide (CID 115567946) is 4-ethyl-N-octylpiperidine-4-carboxamide.
What is the SMILES notation for 4-ethyl-N-octylpiperidine-4-carboxamide?
The canonical SMILES for 4-ethyl-N-octylpiperidine-4-carboxamide is CCCCCCCCNC(=O)C1(CC)CCNCC1.
What is the InChIKey of 4-ethyl-N-octylpiperidine-4-carboxamide?
The InChIKey is NSTGCOKSHNQGBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-5-6-7-8-9-12-18-15(19)16(4-2)10-13-17-14-11-16/h17H,3-14H2,1-2H3,(H,18,19).
What are the key properties of 4-ethyl-N-octylpiperidine-4-carboxamide?
4-ethyl-N-octylpiperidine-4-carboxamide has a molecular weight of 268.44 g/mol, XLogP of 3.24, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-octylpiperidine-4-carboxamide is sourced from PubChem (CID 115567946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).