5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide

C16H23FN2O — CID 63050163

IUPAC5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
SMILESCCCN(C(=O)c1cc(F)ccc1C)C1CCCNC1
InChIInChI=1S/C16H23FN2O/c1-3-9-19(14-5-4-8-18-11-14)16(20)15-10-13(17)7-6-12(15)2/h6-7,10,14,18H,3-5,8-9,11H2,1-2H3
InChIKeyGGRZQEFGSKZEJA-UHFFFAOYSA-N
MW278.37 g/mol
LogP2.74
Rot. Bonds4

About 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide

5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide (PubChem CID 63050163) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide.

Molecular Properties

Compound Name5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
PubChem CID63050163
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC Name5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
SMILESCCCN(C(=O)c1cc(F)ccc1C)C1CCCNC1
InChIInChI=1S/C16H23FN2O/c1-3-9-19(14-5-4-8-18-11-14)16(20)15-10-13(17)7-6-12(15)2/h6-7,10,14,18H,3-5,8-9,11H2,1-2H3
InChIKeyGGRZQEFGSKZEJA-UHFFFAOYSA-N
XLogP2.74
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-N,2-dimethyl-N-piperidin-3-ylbenzamide
CID 55228435
2,5-dimethyl-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 60805843
4-fluoro-3-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63209531
2-(4-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide
CID 60805878
2-chloro-4-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 106862150
5-fluoro-N-piperidin-3-yl-N-propylpyridine-2-carboxamide
CID 104639262
N-ethyl-5-fluoro-2-methyl-N-piperidin-4-ylbenzamide
CID 63048793
6-methyl-2-oxo-N-piperidin-3-yl-N-propyl-1H-pyridine-3-carboxamide
CID 104772838
3-methyl-N-piperidin-3-yl-N-propylthiophene-2-carboxamide
CID 63636574
5-chloro-2-hydroxy-N-piperidin-3-yl-N-propylbenzamide
CID 63636752
5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627610
4-bromo-2-chloro-N-piperidin-3-yl-N-propylbenzamide
CID 63637268

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide?
The IUPAC name of 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide (CID 63050163) is 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide.
What is the SMILES notation for 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide?
The canonical SMILES for 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide is CCCN(C(=O)c1cc(F)ccc1C)C1CCCNC1.
What is the InChIKey of 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide?
The InChIKey is GGRZQEFGSKZEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-3-9-19(14-5-4-8-18-11-14)16(20)15-10-13(17)7-6-12(15)2/h6-7,10,14,18H,3-5,8-9,11H2,1-2H3.
What are the key properties of 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide?
5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide has a molecular weight of 278.37 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide is sourced from PubChem (CID 63050163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).