2-decyl-4,6-dimethylpiperidine-3-carboxamide

C18H36N2O — CID 106778721

IUPAC2-decyl-4,6-dimethylpiperidine-3-carboxamide
SMILESCCCCCCCCCCC1NC(C)CC(C)C1C(N)=O
InChIInChI=1S/C18H36N2O/c1-4-5-6-7-8-9-10-11-12-16-17(18(19)21)14(2)13-15(3)20-16/h14-17,20H,4-13H2,1-3H3,(H2,19,21)
InChIKeyBOIPTDTUYIXTPL-UHFFFAOYSA-N
MW296.50 g/mol
LogP4.01
Rot. Bonds10

About 2-decyl-4,6-dimethylpiperidine-3-carboxamide

2-decyl-4,6-dimethylpiperidine-3-carboxamide (PubChem CID 106778721) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 2-decyl-4,6-dimethylpiperidine-3-carboxamide.

Molecular Properties

Compound Name2-decyl-4,6-dimethylpiperidine-3-carboxamide
PubChem CID106778721
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name2-decyl-4,6-dimethylpiperidine-3-carboxamide
SMILESCCCCCCCCCCC1NC(C)CC(C)C1C(N)=O
InChIInChI=1S/C18H36N2O/c1-4-5-6-7-8-9-10-11-12-16-17(18(19)21)14(2)13-15(3)20-16/h14-17,20H,4-13H2,1-3H3,(H2,19,21)
InChIKeyBOIPTDTUYIXTPL-UHFFFAOYSA-N
XLogP4.01
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 54.01
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

4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide
CID 106778748
3-tridecylaziridine-2-carboxamide
CID 13310343
2-[(4-fluorophenyl)methyl]-4,6-dimethylpiperidine-3-carboxamide
CID 106777741
(2S,4R)-4-hexylpiperidine-2-carboxamide
CID 142863438
2-[(2-methoxyphenyl)methyl]-4,6-dimethylpiperidine-3-carboxamide
CID 106778055
2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-4,6-dimethylpiperidine-3-carboxamide
CID 106780274
4-decyl-1,1-dioxothiolane-2-carboxamide
CID 154270507
10-[(1R,2S)-2-hexylcyclopropyl]decanamide
CID 90478669
(4R,5S)-5-butyl-4-methylpyrrolidine-2-carboxylic acid
CID 70317772
1-methyl-2-pentadecylcyclopropane
CID 54385825
1,3-dimethyl-2-pentylcyclobutane
CID 91222798
1,2-di(tetradecyl)pyrrolidine-3,4-dicarboxamide
CID 175161181

Frequently Asked Questions

What is the IUPAC name of 2-decyl-4,6-dimethylpiperidine-3-carboxamide?
The IUPAC name of 2-decyl-4,6-dimethylpiperidine-3-carboxamide (CID 106778721) is 2-decyl-4,6-dimethylpiperidine-3-carboxamide.
What is the SMILES notation for 2-decyl-4,6-dimethylpiperidine-3-carboxamide?
The canonical SMILES for 2-decyl-4,6-dimethylpiperidine-3-carboxamide is CCCCCCCCCCC1NC(C)CC(C)C1C(N)=O.
What is the InChIKey of 2-decyl-4,6-dimethylpiperidine-3-carboxamide?
The InChIKey is BOIPTDTUYIXTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-5-6-7-8-9-10-11-12-16-17(18(19)21)14(2)13-15(3)20-16/h14-17,20H,4-13H2,1-3H3,(H2,19,21).
What are the key properties of 2-decyl-4,6-dimethylpiperidine-3-carboxamide?
2-decyl-4,6-dimethylpiperidine-3-carboxamide has a molecular weight of 296.50 g/mol, XLogP of 4.01, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-decyl-4,6-dimethylpiperidine-3-carboxamide is sourced from PubChem (CID 106778721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).