N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide

C14H18F2N2O — CID 108990928

IUPACN-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide
SMILESCCC1CCCCN1C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C14H18F2N2O/c1-2-10-6-3-4-9-18(10)14(19)17-13-11(15)7-5-8-12(13)16/h5,7-8,10H,2-4,6,9H2,1H3,(H,17,19)
InChIKeyHBRUVLOQULQGRH-UHFFFAOYSA-N
MW268.31 g/mol
LogP3.76
Rot. Bonds2

About N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide

N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide (PubChem CID 108990928) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide
PubChem CID108990928
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC NameN-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide
SMILESCCC1CCCCN1C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C14H18F2N2O/c1-2-10-6-3-4-9-18(10)14(19)17-13-11(15)7-5-8-12(13)16/h5,7-8,10H,2-4,6,9H2,1H3,(H,17,19)
InChIKeyHBRUVLOQULQGRH-UHFFFAOYSA-N
XLogP3.76
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,6-dichlorophenyl)-2-ethylpiperidine-1-carboxamide
CID 108990919
(2R)-2-ethyl-N-[3-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]phenyl]piperidine-1-carboxamide
CID 7190614
3-fluoro-2-[[2-(hydroxymethyl)piperidine-1-carbonyl]amino]benzoic acid
CID 81497850
(2R)-2-ethyl-N-phenylpiperidine-1-carboxamide
CID 728630
N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide
CID 3111956
N-[4-(aminomethyl)phenyl]-2-ethylazepane-1-carboxamide
CID 104690862
2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide
CID 112970222
N-(2,6-difluorophenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetamide
CID 108522156
3-fluoro-2-[(2-methylazepane-1-carbonyl)amino]benzoic acid
CID 81499089
(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
CID 51944426
N-(2-chloro-4,6-dimethylphenyl)-2-ethylpiperidine-1-carboxamide
CID 108990890
N-(4-chloro-2-methylphenyl)-2-ethylpiperidine-1-carboxamide
CID 108990888

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide (CID 108990928) is N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide is CCC1CCCCN1C(=O)Nc1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide?
The InChIKey is HBRUVLOQULQGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-2-10-6-3-4-9-18(10)14(19)17-13-11(15)7-5-8-12(13)16/h5,7-8,10H,2-4,6,9H2,1H3,(H,17,19).
What are the key properties of N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide?
N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide has a molecular weight of 268.31 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide is sourced from PubChem (CID 108990928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).