N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide

C14H18F2N2O — CID 63132090

IUPACN-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide
SMILESCCC1(C(=O)Nc2ccc(F)cc2F)CCCNC1
InChIInChI=1S/C14H18F2N2O/c1-2-14(6-3-7-17-9-14)13(19)18-12-5-4-10(15)8-11(12)16/h4-5,8,17H,2-3,6-7,9H2,1H3,(H,18,19)
InChIKeyZYHIIBACDWCOBG-UHFFFAOYSA-N
MW268.31 g/mol
LogP2.68
Rot. Bonds3

About N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide

N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide (PubChem CID 63132090) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide
PubChem CID63132090
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC NameN-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide
SMILESCCC1(C(=O)Nc2ccc(F)cc2F)CCCNC1
InChIInChI=1S/C14H18F2N2O/c1-2-14(6-3-7-17-9-14)13(19)18-12-5-4-10(15)8-11(12)16/h4-5,8,17H,2-3,6-7,9H2,1H3,(H,18,19)
InChIKeyZYHIIBACDWCOBG-UHFFFAOYSA-N
XLogP2.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-fluorophenyl)-3-ethylpiperidine-3-carboxamide
CID 63130400
3-ethyl-N-(2-fluoro-4-methylphenyl)pyrrolidine-3-carboxamide
CID 63138345
3-ethyl-N-(2,3,5,6-tetrafluorophenyl)piperidine-3-carboxamide
CID 107641764
4-[(3-ethylpyrrolidine-3-carbonyl)amino]-3-fluorobenzoic acid
CID 63187702
N-(4-bromo-2,5-difluorophenyl)-3-ethylpyrrolidine-3-carboxamide
CID 107611749
3-ethyl-N-(3-fluoro-5-methylphenyl)piperidine-3-carboxamide
CID 79049943
1-(aminomethyl)-N-(2,4-difluorophenyl)cyclobutane-1-carboxamide
CID 80586877
N-(3-bromo-4-fluorophenyl)-3-ethylpiperidine-3-carboxamide
CID 104778149
3-ethyl-N-(3-hydroxy-2,4-dimethylphenyl)piperidine-3-carboxamide
CID 63130701
3-ethyl-N-(2-methoxy-4-methylphenyl)piperidine-3-carboxamide
CID 63130989
3-ethyl-N-(4-methoxy-2-methylphenyl)piperidine-3-carboxamide
CID 63132813
3-ethyl-N-[2-(4-fluorophenyl)ethyl]piperidine-3-carboxamide
CID 63132469

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide (CID 63132090) is N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide is CCC1(C(=O)Nc2ccc(F)cc2F)CCCNC1.
What is the InChIKey of N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide?
The InChIKey is ZYHIIBACDWCOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-2-14(6-3-7-17-9-14)13(19)18-12-5-4-10(15)8-11(12)16/h4-5,8,17H,2-3,6-7,9H2,1H3,(H,18,19).
What are the key properties of N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide?
N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide has a molecular weight of 268.31 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-ethylpiperidine-3-carboxamide is sourced from PubChem (CID 63132090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).