3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide

C17H25FN2O2 — CID 86824610

IUPAC3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)CN2CCCCC2)cc1F
InChIInChI=1S/C17H25FN2O2/c1-13(12-20-8-4-3-5-9-20)11-19-17(21)14-6-7-16(22-2)15(18)10-14/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,19,21)
InChIKeyYVPOAMDMXBOOHH-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.69
Rot. Bonds6

About 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide

3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide (PubChem CID 86824610) has the molecular formula C17H25FN2O2 and a molecular weight of 308.40 g/mol. Its IUPAC name is 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
PubChem CID86824610
Molecular FormulaC17H25FN2O2
Molecular Weight308.40 g/mol
Exact Mass308.19
IUPAC Name3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)CN2CCCCC2)cc1F
InChIInChI=1S/C17H25FN2O2/c1-13(12-20-8-4-3-5-9-20)11-19-17(21)14-6-7-16(22-2)15(18)10-14/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,19,21)
InChIKeyYVPOAMDMXBOOHH-UHFFFAOYSA-N
XLogP2.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chloro-2-methylpropyl)-3-fluoro-4-methoxybenzamide
CID 114302762
N-(2-chloropropyl)-3-fluoro-4-methoxybenzamide
CID 114296589
2-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 61292554
2,3,4-trimethoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 55980283
3,4-difluoro-N-[(2S)-2-methyl-3-(4-methylpiperazin-1-yl)propyl]benzamide
CID 95976798
3,4-difluoro-N-(2-methyl-3-morpholin-4-ylpropyl)benzamide
CID 110445678
3-fluoro-4-methoxy-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 17427502
4-bromo-3-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 81295079
3-bromo-4-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 107999448
3-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 62992034
3-fluoro-4-methoxy-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 17446987
3,5-dihydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 103892120

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide (CID 86824610) is 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide is COc1ccc(C(=O)NCC(C)CN2CCCCC2)cc1F.
What is the InChIKey of 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
The InChIKey is YVPOAMDMXBOOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O2/c1-13(12-20-8-4-3-5-9-20)11-19-17(21)14-6-7-16(22-2)15(18)10-14/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,19,21).
What are the key properties of 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide?
3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide has a molecular weight of 308.40 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 86824610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).