N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide

C17H26N2O2 — CID 63129005

IUPACN-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCCOc2ccccc2)CCNCC1
InChIInChI=1S/C17H26N2O2/c1-2-8-17(9-11-18-12-10-17)16(20)19-13-14-21-15-6-4-3-5-7-15/h3-7,18H,2,8-14H2,1H3,(H,19,20)
InChIKeyAMZSWHYDBBNFEW-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.35
Rot. Bonds7

About N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide

N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide (PubChem CID 63129005) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide
PubChem CID63129005
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCCOc2ccccc2)CCNCC1
InChIInChI=1S/C17H26N2O2/c1-2-8-17(9-11-18-12-10-17)16(20)19-13-14-21-15-6-4-3-5-7-15/h3-7,18H,2,8-14H2,1H3,(H,19,20)
InChIKeyAMZSWHYDBBNFEW-UHFFFAOYSA-N
XLogP2.35
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(methoxymethyl)-N-(2-phenoxyethyl)piperidine-4-carboxamide;hydrochloride
CID 120617692
N-(2-aminoethyl)-4-propylpiperidine-4-carboxamide
CID 63128598
N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide
CID 63127671
N-(2-phenoxyethyl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120918777
1-(aminomethyl)-N-(2-phenoxyethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119684516
N-[2-(3-chlorophenoxy)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120623811
4-(methoxymethyl)-N-[2-(2-phenylphenoxy)ethyl]piperidine-4-carboxamide
CID 120626270
N-[2-[ethyl(methyl)amino]ethyl]-4-propylpiperidine-4-carboxamide
CID 55176449
N-[2-(3-bromophenoxy)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119746393
4-methoxy-N-[2-(4-methoxyphenoxy)ethyl]piperidine-4-carboxamide
CID 119694181
3-methyl-N-(3-phenoxypropyl)piperidine-3-carboxamide
CID 63133086
N-[2-(2,6-dimethylphenoxy)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120623806

Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide (CID 63129005) is N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)NCCOc2ccccc2)CCNCC1.
What is the InChIKey of N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide?
The InChIKey is AMZSWHYDBBNFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-2-8-17(9-11-18-12-10-17)16(20)19-13-14-21-15-6-4-3-5-7-15/h3-7,18H,2,8-14H2,1H3,(H,19,20).
What are the key properties of N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide?
N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 63129005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).