4-hexyl-N,N-dimethylpiperidine-2-carboxamide

C14H28N2O — CID 106778401

IUPAC4-hexyl-N,N-dimethylpiperidine-2-carboxamide
SMILESCCCCCCC1CCNC(C(=O)N(C)C)C1
InChIInChI=1S/C14H28N2O/c1-4-5-6-7-8-12-9-10-15-13(11-12)14(17)16(2)3/h12-13,15H,4-11H2,1-3H3
InChIKeyORPWPCCQIRUCOA-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.41
Rot. Bonds6

About 4-hexyl-N,N-dimethylpiperidine-2-carboxamide

4-hexyl-N,N-dimethylpiperidine-2-carboxamide (PubChem CID 106778401) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-hexyl-N,N-dimethylpiperidine-2-carboxamide.

Molecular Properties

Compound Name4-hexyl-N,N-dimethylpiperidine-2-carboxamide
PubChem CID106778401
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name4-hexyl-N,N-dimethylpiperidine-2-carboxamide
SMILESCCCCCCC1CCNC(C(=O)N(C)C)C1
InChIInChI=1S/C14H28N2O/c1-4-5-6-7-8-12-9-10-15-13(11-12)14(17)16(2)3/h12-13,15H,4-11H2,1-3H3
InChIKeyORPWPCCQIRUCOA-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethyl-4-octylpiperidine-2-carboxamide
CID 106778464
N,N-diethyl-4-heptylpiperidine-2-carboxamide
CID 106778380
(2S,4R)-4-hexylpiperidine-2-carboxamide
CID 142863438
N,N-dibutyl-4-ethylpiperidine-2-carboxamide
CID 114428005
(2R)-N,N-dimethylazetidine-2-carboxamide
CID 124537269
4-hexadecylpiperidine
CID 54096875
4-ethyl-N-methyl-N-[(2-methylcyclopropyl)methyl]piperidine-2-carboxamide
CID 114429063
4-heptylpiperidine;methane
CID 144690559
4-ethyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylpiperidine-2-carboxamide
CID 114948966
4-cycloheptyl-N,N-dimethylpiperidine-2-carboxamide
CID 106781028
4-[(3-ethyl-1-methylpyrazol-5-yl)methyl]-N,N-dimethylpiperidine-2-carboxamide
CID 106779974
4-ethyl-N-methyl-N-(4-methylpentan-2-yl)piperidine-2-carboxamide
CID 114428433

Frequently Asked Questions

What is the IUPAC name of 4-hexyl-N,N-dimethylpiperidine-2-carboxamide?
The IUPAC name of 4-hexyl-N,N-dimethylpiperidine-2-carboxamide (CID 106778401) is 4-hexyl-N,N-dimethylpiperidine-2-carboxamide.
What is the SMILES notation for 4-hexyl-N,N-dimethylpiperidine-2-carboxamide?
The canonical SMILES for 4-hexyl-N,N-dimethylpiperidine-2-carboxamide is CCCCCCC1CCNC(C(=O)N(C)C)C1.
What is the InChIKey of 4-hexyl-N,N-dimethylpiperidine-2-carboxamide?
The InChIKey is ORPWPCCQIRUCOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-5-6-7-8-12-9-10-15-13(11-12)14(17)16(2)3/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 4-hexyl-N,N-dimethylpiperidine-2-carboxamide?
4-hexyl-N,N-dimethylpiperidine-2-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hexyl-N,N-dimethylpiperidine-2-carboxamide is sourced from PubChem (CID 106778401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).