N,1-dimethyl-N-octylpiperidine-3-carboxamide

C16H32N2O — CID 14306886

IUPACN,1-dimethyl-N-octylpiperidine-3-carboxamide
SMILESCCCCCCCCN(C)C(=O)C1CCCN(C)C1
InChIInChI=1S/C16H32N2O/c1-4-5-6-7-8-9-13-18(3)16(19)15-11-10-12-17(2)14-15/h15H,4-14H2,1-3H3
InChIKeyMHUWYQQDJWOHEI-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.15
Rot. Bonds8

About N,1-dimethyl-N-octylpiperidine-3-carboxamide

N,1-dimethyl-N-octylpiperidine-3-carboxamide (PubChem CID 14306886) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N,1-dimethyl-N-octylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-octylpiperidine-3-carboxamide
PubChem CID14306886
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN,1-dimethyl-N-octylpiperidine-3-carboxamide
SMILESCCCCCCCCN(C)C(=O)C1CCCN(C)C1
InChIInChI=1S/C16H32N2O/c1-4-5-6-7-8-9-13-18(3)16(19)15-11-10-12-17(2)14-15/h15H,4-14H2,1-3H3
InChIKeyMHUWYQQDJWOHEI-UHFFFAOYSA-N
XLogP3.15
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.15
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
Ketone, 1-methyl-3-piperidyl piperidino
CID 218423
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

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-octylpiperidine-3-carboxamide?
The IUPAC name of N,1-dimethyl-N-octylpiperidine-3-carboxamide (CID 14306886) is N,1-dimethyl-N-octylpiperidine-3-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-octylpiperidine-3-carboxamide?
The canonical SMILES for N,1-dimethyl-N-octylpiperidine-3-carboxamide is CCCCCCCCN(C)C(=O)C1CCCN(C)C1.
What is the InChIKey of N,1-dimethyl-N-octylpiperidine-3-carboxamide?
The InChIKey is MHUWYQQDJWOHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-5-6-7-8-9-13-18(3)16(19)15-11-10-12-17(2)14-15/h15H,4-14H2,1-3H3.
What are the key properties of N,1-dimethyl-N-octylpiperidine-3-carboxamide?
N,1-dimethyl-N-octylpiperidine-3-carboxamide has a molecular weight of 268.44 g/mol, XLogP of 3.15, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-octylpiperidine-3-carboxamide is sourced from PubChem (CID 14306886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).