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

C15H21FN2O — CID 63127725

IUPAC4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide
SMILESCCC1(C(=O)NCc2cccc(F)c2)CCNCC1
InChIInChI=1S/C15H21FN2O/c1-2-15(6-8-17-9-7-15)14(19)18-11-12-4-3-5-13(16)10-12/h3-5,10,17H,2,6-9,11H2,1H3,(H,18,19)
InChIKeyFVBSFTCAWNJLBH-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.22
Rot. Bonds4

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

4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide (PubChem CID 63127725) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide
PubChem CID63127725
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide
SMILESCCC1(C(=O)NCc2cccc(F)c2)CCNCC1
InChIInChI=1S/C15H21FN2O/c1-2-15(6-8-17-9-7-15)14(19)18-11-12-4-3-5-13(16)10-12/h3-5,10,17H,2,6-9,11H2,1H3,(H,18,19)
InChIKeyFVBSFTCAWNJLBH-UHFFFAOYSA-N
XLogP2.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-[(3-fluorophenyl)methyl]pyrrolidine-3-carboxamide
CID 55165134
N-[(3-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127726
N-[(3-ethoxyphenyl)methyl]-4-ethylpiperidine-4-carboxamide
CID 63128509
3-ethyl-N-[[3-(hydroxymethyl)phenyl]methyl]piperidine-3-carboxamide
CID 107218375
N-[(3-methylphenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63128555
4-[[(4-ethylpiperidine-4-carbonyl)amino]methyl]benzoic acid
CID 63128895
N-[(4-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127194
N-[(3-chlorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127551
2,2-dichloro-N-[(3-fluorophenyl)methyl]-1-methylcyclopropane-1-carboxamide
CID 46447833
methyl 1-[(3-fluorophenyl)methylcarbamoyl]cyclopropane-1-carboxylate
CID 115184452
N-[(3-fluorophenyl)methyl]-1-hydroxycyclopentane-1-carboxamide
CID 110907192
3-ethyl-N-[(3-sulfamoylphenyl)methyl]pyrrolidine-3-carboxamide
CID 63139949

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide (CID 63127725) is 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide is CCC1(C(=O)NCc2cccc(F)c2)CCNCC1.
What is the InChIKey of 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide?
The InChIKey is FVBSFTCAWNJLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-2-15(6-8-17-9-7-15)14(19)18-11-12-4-3-5-13(16)10-12/h3-5,10,17H,2,6-9,11H2,1H3,(H,18,19).
What are the key properties of 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide?
4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide has a molecular weight of 264.34 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 63127725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).