N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide

C15H20F2N2O — CID 82816613

IUPACN-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide
SMILESCCN(C(=O)c1c(F)ccc(C)c1F)C1CCNCC1
InChIInChI=1S/C15H20F2N2O/c1-3-19(11-6-8-18-9-7-11)15(20)13-12(16)5-4-10(2)14(13)17/h4-5,11,18H,3,6-9H2,1-2H3
InChIKeyMQFXGPGRPMOPGT-UHFFFAOYSA-N
MW282.33 g/mol
LogP2.49
Rot. Bonds3

About N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide

N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide (PubChem CID 82816613) has the molecular formula C15H20F2N2O and a molecular weight of 282.33 g/mol. Its IUPAC name is N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide
PubChem CID82816613
Molecular FormulaC15H20F2N2O
Molecular Weight282.33 g/mol
Exact Mass282.15
IUPAC NameN-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide
SMILESCCN(C(=O)c1c(F)ccc(C)c1F)C1CCNCC1
InChIInChI=1S/C15H20F2N2O/c1-3-19(11-6-8-18-9-7-11)15(20)13-12(16)5-4-10(2)14(13)17/h4-5,11,18H,3,6-9H2,1-2H3
InChIKeyMQFXGPGRPMOPGT-UHFFFAOYSA-N
XLogP2.49
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.33
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide
CID 82816537
N-ethyl-2-fluoro-3-methyl-N-piperidin-4-ylbenzamide
CID 81477812
2,6-difluoro-N,3-dimethyl-N-pyrrolidin-3-ylbenzamide
CID 82815007
N-ethyl-2,6-difluoro-3-nitro-N-pyrrolidin-3-ylbenzamide
CID 79759439
N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide
CID 63048793
N-ethyl-2,6-dihydroxy-N-piperidin-4-ylbenzamide
CID 107688542
ethyl 2-[cyclopropyl-(2,6-difluoro-3-methylbenzoyl)amino]acetate
CID 82799836
4-chloro-N-ethyl-N-piperidin-4-ylbenzamide
CID 54923441
N-(cyanomethyl)-N-cyclopentyl-2,6-difluoro-3-methylbenzamide
CID 82814308
N-(3-aminopropyl)-N-cyclopentyl-2,6-difluoro-3-methylbenzamide
CID 82798367
N-ethyl-2-fluoro-5-methyl-N-pyrrolidin-3-ylbenzamide
CID 62514257
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide?
The IUPAC name of N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide (CID 82816613) is N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide.
What is the SMILES notation for N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide?
The canonical SMILES for N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide is CCN(C(=O)c1c(F)ccc(C)c1F)C1CCNCC1.
What is the InChIKey of N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide?
The InChIKey is MQFXGPGRPMOPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O/c1-3-19(11-6-8-18-9-7-11)15(20)13-12(16)5-4-10(2)14(13)17/h4-5,11,18H,3,6-9H2,1-2H3.
What are the key properties of N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide?
N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide has a molecular weight of 282.33 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 82816613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).