N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide

C16H24FN3O — CID 119920472

IUPACN-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
SMILESCNC1CCCN(CCC(=O)Nc2cccc(F)c2C)C1
InChIInChI=1S/C16H24FN3O/c1-12-14(17)6-3-7-15(12)19-16(21)8-10-20-9-4-5-13(11-20)18-2/h3,6-7,13,18H,4-5,8-11H2,1-2H3,(H,19,21)
InChIKeyQCDKYMXQGRMYKL-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.15
Rot. Bonds5

About N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide

N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide (PubChem CID 119920472) has the molecular formula C16H24FN3O and a molecular weight of 293.39 g/mol. Its IUPAC name is N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
PubChem CID119920472
Molecular FormulaC16H24FN3O
Molecular Weight293.39 g/mol
Exact Mass293.19
IUPAC NameN-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
SMILESCNC1CCCN(CCC(=O)Nc2cccc(F)c2C)C1
InChIInChI=1S/C16H24FN3O/c1-12-14(17)6-3-7-15(12)19-16(21)8-10-20-9-4-5-13(11-20)18-2/h3,6-7,13,18H,4-5,8-11H2,1-2H3,(H,19,21)
InChIKeyQCDKYMXQGRMYKL-UHFFFAOYSA-N
XLogP2.15
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide 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

3-[3-(methylamino)piperidin-1-yl]-N-(2-methyl-3-nitrophenyl)propanamide;hydrochloride
CID 119919127
N-(2-fluorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919928
N-(2,3-dimethylphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62546867
N-(2,5-dichlorophenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119920297
N-(3-fluoro-2-methylphenyl)-3-(3-indazol-1-ylpyrrolidin-1-yl)propanamide
CID 166206651
N-(2-fluorophenyl)-3-(4-hydroxy-3-methylpiperidin-1-yl)propanamide
CID 114681385
N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 119919130
3-(3-acetamidopiperidin-1-yl)-N-(2,5-difluorophenyl)propanamide
CID 91841794
4-[3-(methylamino)piperidin-1-yl]-N-(3-methylphenyl)butanamide
CID 62546343
N-(2-fluorophenyl)-3-(3-propoxypiperidin-1-yl)propanamide
CID 91836390
3-[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-N-(3-fluoro-2-methylphenyl)propanamide
CID 120759781
N-(2-fluorophenyl)-3-[3-(methylaminomethyl)pyrrolidin-1-yl]propanamide
CID 63264342

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
The IUPAC name of N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide (CID 119920472) is N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
The canonical SMILES for N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide is CNC1CCCN(CCC(=O)Nc2cccc(F)c2C)C1.
What is the InChIKey of N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
The InChIKey is QCDKYMXQGRMYKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O/c1-12-14(17)6-3-7-15(12)19-16(21)8-10-20-9-4-5-13(11-20)18-2/h3,6-7,13,18H,4-5,8-11H2,1-2H3,(H,19,21).
What are the key properties of N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide has a molecular weight of 293.39 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide is sourced from PubChem (CID 119920472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).