N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide

C26H42N2O2 — CID 54791960

IUPACN-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1cccc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C26H42N2O2/c1-2-3-4-5-6-7-8-9-10-11-13-19-25(29)27-24-18-16-17-23(22-24)26(30)28-20-14-12-15-21-28/h16-18,22H,2-15,19-21H2,1H3,(H,27,29)
InChIKeyDFONYRBSNQPBJL-UHFFFAOYSA-N
MW414.63 g/mol
LogP6.95
Rot. Bonds14

About N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide

N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide (PubChem CID 54791960) has the molecular formula C26H42N2O2 and a molecular weight of 414.63 g/mol. Its IUPAC name is N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide.

Molecular Properties

Compound NameN-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide
PubChem CID54791960
Molecular FormulaC26H42N2O2
Molecular Weight414.63 g/mol
Exact Mass414.32
IUPAC NameN-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1cccc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C26H42N2O2/c1-2-3-4-5-6-7-8-9-10-11-13-19-25(29)27-24-18-16-17-23(22-24)26(30)28-20-14-12-15-21-28/h16-18,22H,2-15,19-21H2,1H3,(H,27,29)
InChIKeyDFONYRBSNQPBJL-UHFFFAOYSA-N
XLogP6.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.63
LogP ≤ 56.95
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-[3-[[2-[3-(azepane-1-carbonyl)anilino]acetyl]amino]phenyl]hexanamide
CID 54841375
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]octanamide
CID 43886892
N-[3-(azepane-1-carbonyl)phenyl]-4-chlorobutanamide
CID 26159666
5-oxo-5-phenyl-N-[3-(pyrrolidine-1-carbonyl)phenyl]pentanamide
CID 110353707
N-[3-[[2-[3-(morpholine-4-carbonyl)anilino]acetyl]amino]phenyl]hexanamide
CID 54836346
2-(4-hexoxyanilino)-N-[3-(piperidine-1-carbonyl)phenyl]acetamide
CID 54821096
N-[3-[[2-(azepan-1-yl)-2-oxoethyl]amino]phenyl]hexanamide
CID 54842689
4-amino-N-[3-(piperidine-1-carbonyl)phenyl]pentanamide;hydrochloride
CID 120560909
2-[3-(azepane-1-carbonyl)anilino]-N-hexadecylacetamide
CID 54841517
3-(heptanoylamino)benzamide
CID 54789184
4-hexoxy-N-[3-(piperidine-1-carbonyl)phenyl]benzamide
CID 26168496
2-(methylamino)-N-[3-(piperidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119740126

Frequently Asked Questions

What is the IUPAC name of N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide?
The IUPAC name of N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide (CID 54791960) is N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide.
What is the SMILES notation for N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide?
The canonical SMILES for N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1cccc(C(=O)N2CCCCC2)c1.
What is the InChIKey of N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide?
The InChIKey is DFONYRBSNQPBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H42N2O2/c1-2-3-4-5-6-7-8-9-10-11-13-19-25(29)27-24-18-16-17-23(22-24)26(30)28-20-14-12-15-21-28/h16-18,22H,2-15,19-21H2,1H3,(H,27,29).
What are the key properties of N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide?
N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide has a molecular weight of 414.63 g/mol, XLogP of 6.95, 14 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(piperidine-1-carbonyl)phenyl]tetradecanamide is sourced from PubChem (CID 54791960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).