3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide

C19H22FNO2 — CID 43035024

IUPAC3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1cccc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C19H22FNO2/c1-13(2)14(3)21-19(22)16-5-4-6-18(11-16)23-12-15-7-9-17(20)10-8-15/h4-11,13-14H,12H2,1-3H3,(H,21,22)
InChIKeySCDPTBGDQHZQGK-UHFFFAOYSA-N
MW315.39 g/mol
LogP4.18
Rot. Bonds6

About 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide

3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide (PubChem CID 43035024) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide
PubChem CID43035024
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC Name3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1cccc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C19H22FNO2/c1-13(2)14(3)21-19(22)16-5-4-6-18(11-16)23-12-15-7-9-17(20)10-8-15/h4-11,13-14H,12H2,1-3H3,(H,21,22)
InChIKeySCDPTBGDQHZQGK-UHFFFAOYSA-N
XLogP4.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-3-methylbutan-2-yl]-4-(phenoxymethyl)benzamide
CID 41380086
methyl 3-[[3-[(4-fluorophenyl)methoxy]benzoyl]amino]-3-phenylpropanoate
CID 46657420
N-[cyano-(2-fluorophenyl)methyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 56572178
3-[(4-fluorophenyl)methoxy]benzamide
CID 18354605
N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 55901297
[1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate
CID 46816794
3-[(4-fluorophenyl)methoxy]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 24647665
3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide
CID 55612328
N-[4-(2-amino-2-oxoethyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 31857522
3-(4-fluorophenoxy)-N-propan-2-ylbenzamide
CID 12941904
3-[(4-fluorophenyl)methoxy]-N-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzamide
CID 24554638
3-cyano-N-[3-[(4-fluorophenyl)methoxy]phenyl]benzamide
CID 46594970

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide?
The IUPAC name of 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide (CID 43035024) is 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide.
What is the SMILES notation for 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide?
The canonical SMILES for 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide is CC(C)C(C)NC(=O)c1cccc(OCc2ccc(F)cc2)c1.
What is the InChIKey of 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide?
The InChIKey is SCDPTBGDQHZQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-13(2)14(3)21-19(22)16-5-4-6-18(11-16)23-12-15-7-9-17(20)10-8-15/h4-11,13-14H,12H2,1-3H3,(H,21,22).
What are the key properties of 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide?
3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide has a molecular weight of 315.39 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide is sourced from PubChem (CID 43035024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).