1-decyl-N,N-dimethylpiperidine-3-carboxamide

C18H36N2O — CID 90679729

IUPAC1-decyl-N,N-dimethylpiperidine-3-carboxamide
SMILESCCCCCCCCCCN1CCCC(C(=O)N(C)C)C1
InChIInChI=1S/C18H36N2O/c1-4-5-6-7-8-9-10-11-14-20-15-12-13-17(16-20)18(21)19(2)3/h17H,4-16H2,1-3H3
InChIKeyMTMUCWVKDIMNHU-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.93
Rot. Bonds10

About 1-decyl-N,N-dimethylpiperidine-3-carboxamide

1-decyl-N,N-dimethylpiperidine-3-carboxamide (PubChem CID 90679729) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is 1-decyl-N,N-dimethylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-decyl-N,N-dimethylpiperidine-3-carboxamide
PubChem CID90679729
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC Name1-decyl-N,N-dimethylpiperidine-3-carboxamide
SMILESCCCCCCCCCCN1CCCC(C(=O)N(C)C)C1
InChIInChI=1S/C18H36N2O/c1-4-5-6-7-8-9-10-11-14-20-15-12-13-17(16-20)18(21)19(2)3/h17H,4-16H2,1-3H3
InChIKeyMTMUCWVKDIMNHU-UHFFFAOYSA-N
XLogP3.93
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,1'-(Decane-1,10-diyl)bis(N,N-diethylpiperidine-3-carboxamide)--hydrogen bromide (1/2)
CID 121330
1-decyl-3-(N,N-diethylcarbamoyl)piperidine hydrobromide
CID 3035280
1-Decyl-3-(N,N-diethylcarbamoyl)piperidine
CID 120652
N,N-Diethyl-1-methylpiperidine-3-carboxamide
CID 18785
1-Heptylnipecotamide
CID 4107524
1-Dodecylnipecotamide
CID 4178345
1-decyl-N-ethyl-N-methylpiperidine-3-carboxamide
CID 90679730
1-decyl-N,N-dipropylpiperidine-3-carboxamide
CID 90679731
1-Decylpiperidine-3-carboxamide
CID 20208765
1-decyl-N-ethylpiperidine-3-carboxamide
CID 20208772
1-Octadecylnipecotamide
CID 4250184
1-[8-[3-(diethylcarbamoyl)piperidin-1-yl]octyl]-N,N-diethylpiperidine-3-carboxamide;dihydrobromide
CID 49859997

Frequently Asked Questions

What is the IUPAC name of 1-decyl-N,N-dimethylpiperidine-3-carboxamide?
The IUPAC name of 1-decyl-N,N-dimethylpiperidine-3-carboxamide (CID 90679729) is 1-decyl-N,N-dimethylpiperidine-3-carboxamide.
What is the SMILES notation for 1-decyl-N,N-dimethylpiperidine-3-carboxamide?
The canonical SMILES for 1-decyl-N,N-dimethylpiperidine-3-carboxamide is CCCCCCCCCCN1CCCC(C(=O)N(C)C)C1.
What is the InChIKey of 1-decyl-N,N-dimethylpiperidine-3-carboxamide?
The InChIKey is MTMUCWVKDIMNHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-4-5-6-7-8-9-10-11-14-20-15-12-13-17(16-20)18(21)19(2)3/h17H,4-16H2,1-3H3.
What are the key properties of 1-decyl-N,N-dimethylpiperidine-3-carboxamide?
1-decyl-N,N-dimethylpiperidine-3-carboxamide has a molecular weight of 296.50 g/mol, XLogP of 3.93, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decyl-N,N-dimethylpiperidine-3-carboxamide is sourced from PubChem (CID 90679729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).