N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide

C15H21FN2O — CID 63048793

IUPACN-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide
SMILESCCN(C(=O)c1cc(F)ccc1C)C1CCNCC1
InChIInChI=1S/C15H21FN2O/c1-3-18(13-6-8-17-9-7-13)15(19)14-10-12(16)5-4-11(14)2/h4-5,10,13,17H,3,6-9H2,1-2H3
InChIKeyPRRINAOCMOIZIB-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.35
Rot. Bonds3

About N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide

N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide (PubChem CID 63048793) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide
PubChem CID63048793
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide
SMILESCCN(C(=O)c1cc(F)ccc1C)C1CCNCC1
InChIInChI=1S/C15H21FN2O/c1-3-18(13-6-8-17-9-7-13)15(19)14-10-12(16)5-4-11(14)2/h4-5,10,13,17H,3,6-9H2,1-2H3
InChIKeyPRRINAOCMOIZIB-UHFFFAOYSA-N
XLogP2.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-5-fluoro-2-hydroxy-N-piperidin-4-ylbenzamide
CID 115299350
N-ethyl-2-fluoro-3-methyl-N-piperidin-4-ylbenzamide
CID 81477812
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085
5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63050163
N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide
CID 82816613
4-bromo-N-ethyl-2-fluoro-N-piperidin-4-ylbenzamide
CID 54923872
N-ethyl-2-fluoro-5-methyl-N-pyrrolidin-3-ylbenzamide
CID 62514257
3-chloro-N-ethyl-2-fluoro-N-piperidin-4-ylbenzamide
CID 81264812
5-fluoro-N,2-dimethyl-N-piperidin-3-ylbenzamide
CID 55228435
N-(2-amino-2-oxoethyl)-2,5-difluoro-N-piperidin-4-ylbenzamide
CID 60799815
2-bromo-N-cyclopropyl-N-ethyl-4-fluorobenzamide
CID 43243374
2-amino-N-cyclopropyl-N-ethyl-4-fluorobenzamide
CID 63109697

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide?
The IUPAC name of N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide (CID 63048793) is N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide.
What is the SMILES notation for N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide?
The canonical SMILES for N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide is CCN(C(=O)c1cc(F)ccc1C)C1CCNCC1.
What is the InChIKey of N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide?
The InChIKey is PRRINAOCMOIZIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-3-18(13-6-8-17-9-7-13)15(19)14-10-12(16)5-4-11(14)2/h4-5,10,13,17H,3,6-9H2,1-2H3.
What are the key properties of N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide?
N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide has a molecular weight of 264.34 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 63048793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).