N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide

C16H23FN2O — CID 60947943

IUPACN-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
SMILESCCN(C(=O)C1CCCNC1)C(C)c1ccc(F)cc1
InChIInChI=1S/C16H23FN2O/c1-3-19(16(20)14-5-4-10-18-11-14)12(2)13-6-8-15(17)9-7-13/h6-9,12,14,18H,3-5,10-11H2,1-2H3
InChIKeyJBVFTSGEZZOTAD-UHFFFAOYSA-N
MW278.37 g/mol
LogP2.73
Rot. Bonds4

About N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide

N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide (PubChem CID 60947943) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
PubChem CID60947943
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC NameN-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
SMILESCCN(C(=O)C1CCCNC1)C(C)c1ccc(F)cc1
InChIInChI=1S/C16H23FN2O/c1-3-19(16(20)14-5-4-10-18-11-14)12(2)13-6-8-15(17)9-7-13/h6-9,12,14,18H,3-5,10-11H2,1-2H3
InChIKeyJBVFTSGEZZOTAD-UHFFFAOYSA-N
XLogP2.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxamide
CID 119329896
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-3-methylpiperidine-2-carboxamide
CID 107067743
N-ethyl-N-[1-(4-fluorophenyl)ethyl]azepane-2-carboxamide
CID 64563430
(3S)-N-methyl-N-[1-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81129873
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-4-ylacetamide
CID 61029614
N-ethyl-N-[1-[4-(3-methoxyphenyl)phenyl]ethyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119813208
N-[(4-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 43579181
(3R)-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
CID 81139962
N-ethyl-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 60794877
N-[1-(4-chlorophenyl)ethyl]-N-cyclopropylpiperidine-3-carboxamide
CID 119297631
(3R)-N-ethyl-N-(3-fluorophenyl)piperidine-3-carboxamide
CID 81140928
N-cyclopropyl-N-[(4-fluorophenyl)methyl]piperidine-3-carboxamide
CID 60937275

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide?
The IUPAC name of N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide (CID 60947943) is N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide is CCN(C(=O)C1CCCNC1)C(C)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide?
The InChIKey is JBVFTSGEZZOTAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-3-19(16(20)14-5-4-10-18-11-14)12(2)13-6-8-15(17)9-7-13/h6-9,12,14,18H,3-5,10-11H2,1-2H3.
What are the key properties of N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide?
N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide has a molecular weight of 278.37 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[1-(4-fluorophenyl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 60947943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).