2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride

C18H22ClFN2O2 — CID 120833129

IUPAC2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride
SMILESCNC(C)CNC(=O)c1ccccc1OCc1ccc(F)cc1.Cl
InChIInChI=1S/C18H21FN2O2.ClH/c1-13(20-2)11-21-18(22)16-5-3-4-6-17(16)23-12-14-7-9-15(19)10-8-14;/h3-10,13,20H,11-12H2,1-2H3,(H,21,22);1H
InChIKeyXLOBPASYXCCZTH-UHFFFAOYSA-N
MW352.84 g/mol
LogP3.16
Rot. Bonds7

About 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride

2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride (PubChem CID 120833129) has the molecular formula C18H22ClFN2O2 and a molecular weight of 352.84 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride
PubChem CID120833129
Molecular FormulaC18H22ClFN2O2
Molecular Weight352.84 g/mol
Exact Mass352.14
IUPAC Name2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride
SMILESCNC(C)CNC(=O)c1ccccc1OCc1ccc(F)cc1.Cl
InChIInChI=1S/C18H21FN2O2.ClH/c1-13(20-2)11-21-18(22)16-5-3-4-6-17(16)23-12-14-7-9-15(19)10-8-14;/h3-10,13,20H,11-12H2,1-2H3,(H,21,22);1H
InChIKeyXLOBPASYXCCZTH-UHFFFAOYSA-N
XLogP3.16
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-methylpropyl)-2-[(4-fluorophenyl)methoxy]benzamide;hydrochloride
CID 119626985
2-methoxy-N-[2-(methylamino)propyl]benzamide
CID 103512789
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide
CID 55332202
2-phenylmethoxy-N-(2-phenylpropyl)benzamide
CID 133164529
N-[2-(methylamino)propyl]-2-methylsulfanylbenzamide;hydrochloride
CID 120831488
2-[(4-fluorophenyl)methoxy]-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 55887151
2-[(4-fluorophenyl)methoxy]-N'-phenylbenzohydrazide
CID 78774963
N-[2-(methylamino)propyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 120831701
2,4-difluoro-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120832356
N-(2-fluorophenyl)-2-[(4-fluorophenyl)methoxy]benzamide
CID 26115053
N-benzyl-2-[[4-[[2-(benzylcarbamoyl)phenoxy]methyl]phenyl]methoxy]benzamide
CID 101339913
2-fluoro-3-methyl-N-[2-(methylamino)propyl]benzamide
CID 103512650

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride?
The IUPAC name of 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride (CID 120833129) is 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride.
What is the SMILES notation for 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride?
The canonical SMILES for 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride is CNC(C)CNC(=O)c1ccccc1OCc1ccc(F)cc1.Cl.
What is the InChIKey of 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride?
The InChIKey is XLOBPASYXCCZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O2.ClH/c1-13(20-2)11-21-18(22)16-5-3-4-6-17(16)23-12-14-7-9-15(19)10-8-14;/h3-10,13,20H,11-12H2,1-2H3,(H,21,22);1H.
What are the key properties of 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride?
2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride has a molecular weight of 352.84 g/mol, XLogP of 3.16, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride is sourced from PubChem (CID 120833129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).