3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide

C15H21FN2O — CID 79049943

IUPAC3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide
SMILESCCC1(C(=O)Nc2cc(C)cc(F)c2)CCCNC1
InChIInChI=1S/C15H21FN2O/c1-3-15(5-4-6-17-10-15)14(19)18-13-8-11(2)7-12(16)9-13/h7-9,17H,3-6,10H2,1-2H3,(H,18,19)
InChIKeyCXGTUGAJSPJFSL-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.85
Rot. Bonds3

About 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide

3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide (PubChem CID 79049943) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide
PubChem CID79049943
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide
SMILESCCC1(C(=O)Nc2cc(C)cc(F)c2)CCCNC1
InChIInChI=1S/C15H21FN2O/c1-3-15(5-4-6-17-10-15)14(19)18-13-8-11(2)7-12(16)9-13/h7-9,17H,3-6,10H2,1-2H3,(H,18,19)
InChIKeyCXGTUGAJSPJFSL-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromo-4-fluorophenyl)-3-ethylpiperidine-3-carboxamide
CID 104778149
N-(3-bromophenyl)-3-ethylpiperidine-3-carboxamide
CID 63132260
3-ethyl-N-(2,3,5,6-tetrafluorophenyl)piperidine-3-carboxamide
CID 107641764
N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide
CID 63132090
4-[(3-ethylpiperidine-3-carbonyl)amino]-2-methylbenzoic acid
CID 63135020
N-(3-fluoro-5-methylphenyl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 79049706
3-ethyl-N-(3-methyl-1,2-oxazol-5-yl)piperidine-3-carboxamide
CID 63132332
N-(2,3-dihydro-1H-inden-5-yl)-3-ethylpiperidine-3-carboxamide
CID 63132083
3-[(3-ethylpiperidine-3-carbonyl)amino]benzoic acid
CID 63131356
N-(5-chloro-2-fluorophenyl)-3-ethylpiperidine-3-carboxamide
CID 63130400
1-(aminomethyl)-N-(3-fluoro-5-methylphenyl)cyclopropane-1-carboxamide
CID 115453477
3-ethyl-N-(4-methyl-3-nitrophenyl)piperidine-3-carboxamide
CID 63132622

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide (CID 79049943) is 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide is CCC1(C(=O)Nc2cc(C)cc(F)c2)CCCNC1.
What is the InChIKey of 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide?
The InChIKey is CXGTUGAJSPJFSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-3-15(5-4-6-17-10-15)14(19)18-13-8-11(2)7-12(16)9-13/h7-9,17H,3-6,10H2,1-2H3,(H,18,19).
What are the key properties of 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide?
3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide has a molecular weight of 264.34 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 79049943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).