4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide

C15H21FN2O — CID 114428947

IUPAC4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2ccc(F)c(C)c2)C1
InChIInChI=1S/C15H21FN2O/c1-3-11-6-7-17-14(9-11)15(19)18-12-4-5-13(16)10(2)8-12/h4-5,8,11,14,17H,3,6-7,9H2,1-2H3,(H,18,19)
InChIKeyXSHIJZKMNKGUEW-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.85
Rot. Bonds3

About 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide

4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide (PubChem CID 114428947) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
PubChem CID114428947
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)Nc2ccc(F)c(C)c2)C1
InChIInChI=1S/C15H21FN2O/c1-3-11-6-7-17-14(9-11)15(19)18-12-4-5-13(16)10(2)8-12/h4-5,8,11,14,17H,3,6-7,9H2,1-2H3,(H,18,19)
InChIKeyXSHIJZKMNKGUEW-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

4-ethyl-N-(3-fluoro-4-methoxyphenyl)piperidine-2-carboxamide
CID 114428053
5-[(4-ethylpiperidine-2-carbonyl)amino]-2-methylbenzoic acid
CID 114429036
(2S)-N-(4-fluoro-3-methylphenyl)pyrrolidine-2-carboxamide
CID 62812681
N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
CID 62814041
N-(2,6-difluorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428002
3-[(4-ethylpiperidine-2-carbonyl)amino]-4-fluorobenzoic acid
CID 114428301
4-ethyl-N-(3-fluoro-2-methylphenyl)piperidine-2-carboxamide
CID 114428836
N-[3-chloro-4-(dimethylamino)phenyl]-4-ethylpiperidine-2-carboxamide
CID 114428363
N-(4-carbamoyl-3-chlorophenyl)-4-ethylpiperidine-2-carboxamide
CID 114428317
(2S,4S)-N-(4-fluoro-3-methylphenyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120620325
4-ethyl-N-(2-fluoro-5-nitrophenyl)piperidine-2-carboxamide
CID 114428072
N-(2,3-dimethylphenyl)-4-ethylpiperidine-2-carboxamide
CID 114427932

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide (CID 114428947) is 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)Nc2ccc(F)c(C)c2)C1.
What is the InChIKey of 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide?
The InChIKey is XSHIJZKMNKGUEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-3-11-6-7-17-14(9-11)15(19)18-12-4-5-13(16)10(2)8-12/h4-5,8,11,14,17H,3,6-7,9H2,1-2H3,(H,18,19).
What are the key properties of 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide?
4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-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 4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide is sourced from PubChem (CID 114428947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).