2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide

C20H24FNO2 — CID 13073631

IUPAC2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccccc1OCc1ccc(F)cc1
InChIInChI=1S/C20H24FNO2/c1-3-13-22(14-4-2)20(23)18-7-5-6-8-19(18)24-15-16-9-11-17(21)12-10-16/h5-12H,3-4,13-15H2,1-2H3
InChIKeyMCMFQNHVNMBGLJ-UHFFFAOYSA-N
MW329.42 g/mol
LogP4.67
Rot. Bonds8

About 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide

2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide (PubChem CID 13073631) has the molecular formula C20H24FNO2 and a molecular weight of 329.42 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide
PubChem CID13073631
Molecular FormulaC20H24FNO2
Molecular Weight329.42 g/mol
Exact Mass329.18
IUPAC Name2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccccc1OCc1ccc(F)cc1
InChIInChI=1S/C20H24FNO2/c1-3-13-22(14-4-2)20(23)18-7-5-6-8-19(18)24-15-16-9-11-17(21)12-10-16/h5-12H,3-4,13-15H2,1-2H3
InChIKeyMCMFQNHVNMBGLJ-UHFFFAOYSA-N
XLogP4.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-[[4-(hydroxymethyl)phenyl]methoxy]benzamide
CID 141451288
N-(3-aminopropyl)-N-[(4-fluorophenyl)methyl]-2-[(3-methylphenyl)methoxy]benzamide
CID 71214650
N-(2-amino-2-methylpropyl)-2-[(4-fluorophenyl)methoxy]benzamide;hydrochloride
CID 119626985
N-(2-cyanoethyl)-N-(2-phenylethyl)-2-phenylmethoxybenzamide
CID 54790711
[2-(diethylcarbamoyl)phenyl] N,N-dipropylcarbamate
CID 122517572
N-[2-(2-bromoanilino)-2-oxoethyl]-2-[(4-fluorophenyl)methoxy]-N-methylbenzamide
CID 25161549
2-[(4-fluorophenyl)methoxy]-N'-phenylbenzohydrazide
CID 78774963
methyl 2-[[4-[(2-methoxycarbonylphenoxy)methyl]phenyl]methoxy]benzoate
CID 14323673
2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120833129
N,N-bis(2-cyanoethyl)-2-ethoxybenzamide
CID 2207652
N-(2-fluorophenyl)-2-[(4-fluorophenyl)methoxy]benzamide
CID 26115053
N-(2-bromoethyl)-N-butyl-2-ethoxybenzamide
CID 80659573

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide?
The IUPAC name of 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide (CID 13073631) is 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide.
What is the SMILES notation for 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide?
The canonical SMILES for 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1ccccc1OCc1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide?
The InChIKey is MCMFQNHVNMBGLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO2/c1-3-13-22(14-4-2)20(23)18-7-5-6-8-19(18)24-15-16-9-11-17(21)12-10-16/h5-12H,3-4,13-15H2,1-2H3.
What are the key properties of 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide?
2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide has a molecular weight of 329.42 g/mol, XLogP of 4.67, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methoxy]-N,N-dipropylbenzamide is sourced from PubChem (CID 13073631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).