5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide

C12H17FN2O — CID 103512684

IUPAC5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide
SMILESCNC(C)CNC(=O)c1cc(F)ccc1C
InChIInChI=1S/C12H17FN2O/c1-8-4-5-10(13)6-11(8)12(16)15-7-9(2)14-3/h4-6,9,14H,7H2,1-3H3,(H,15,16)
InChIKeyHGFPPEKHCWLYOR-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.47
Rot. Bonds4

About 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide

5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide (PubChem CID 103512684) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide
PubChem CID103512684
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide
SMILESCNC(C)CNC(=O)c1cc(F)ccc1C
InChIInChI=1S/C12H17FN2O/c1-8-4-5-10(13)6-11(8)12(16)15-7-9(2)14-3/h4-6,9,14H,7H2,1-3H3,(H,15,16)
InChIKeyHGFPPEKHCWLYOR-UHFFFAOYSA-N
XLogP1.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-difluoro-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120832356
N-(3-chloro-2-methylpropyl)-5-fluoro-2-methylbenzamide
CID 114302810
2-fluoro-3-methyl-N-[2-(methylamino)propyl]benzamide
CID 103512650
N-(3-amino-2-hydroxy-3-oxopropyl)-5-fluoro-2-methylbenzamide
CID 107261331
4-fluoro-N-[2-(methylamino)propyl]-2-nitrobenzamide
CID 120832941
4-[(5-fluoro-2-methylbenzoyl)amino]-2-methylbutanoic acid
CID 80538483
2-[(4-fluoro-2-methylphenyl)sulfonylamino]-N-[2-(methylamino)propyl]benzamide
CID 120829039
N-[2-(4-fluorophenyl)propyl]-2,5-dimethylbenzamide
CID 110279740
2-(2,5-dimethylbenzoyl)-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120829826
4,5-dimethoxy-2-methyl-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120827462
N-[(2R)-2-(ethylamino)propyl]-2,5-difluorobenzamide
CID 120651737
(4S)-4-[(5-fluoro-2-methylbenzoyl)amino]pentanoic acid
CID 95359084

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide?
The IUPAC name of 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide (CID 103512684) is 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide.
What is the SMILES notation for 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide?
The canonical SMILES for 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide is CNC(C)CNC(=O)c1cc(F)ccc1C.
What is the InChIKey of 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide?
The InChIKey is HGFPPEKHCWLYOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-8-4-5-10(13)6-11(8)12(16)15-7-9(2)14-3/h4-6,9,14H,7H2,1-3H3,(H,15,16).
What are the key properties of 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide?
5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide has a molecular weight of 224.28 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-N-[2-(methylamino)propyl]benzamide is sourced from PubChem (CID 103512684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).