N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide

C22H20FN3O3 — CID 155947041

IUPACN-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide
SMILESNC(=O)Nc1ccc(CNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1
InChIInChI=1S/C22H20FN3O3/c23-17-9-5-16(6-10-17)14-29-20-4-2-1-3-19(20)21(27)25-13-15-7-11-18(12-8-15)26-22(24)28/h1-12H,13-14H2,(H,25,27)(H3,24,26,28)
InChIKeyLEFBFHQGBHLVMB-UHFFFAOYSA-N
MW393.42 g/mol
LogP3.83
Rot. Bonds7

About N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide

N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide (PubChem CID 155947041) has the molecular formula C22H20FN3O3 and a molecular weight of 393.42 g/mol. Its IUPAC name is N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound NameN-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide
PubChem CID155947041
Molecular FormulaC22H20FN3O3
Molecular Weight393.42 g/mol
Exact Mass393.15
IUPAC NameN-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide
SMILESNC(=O)Nc1ccc(CNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1
InChIInChI=1S/C22H20FN3O3/c23-17-9-5-16(6-10-17)14-29-20-4-2-1-3-19(20)21(27)25-13-15-7-11-18(12-8-15)26-22(24)28/h1-12H,13-14H2,(H,25,27)(H3,24,26,28)
InChIKeyLEFBFHQGBHLVMB-UHFFFAOYSA-N
XLogP3.83
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.42
LogP ≤ 53.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[[4-[[2-(benzylcarbamoyl)phenoxy]methyl]phenyl]methoxy]benzamide
CID 101339913
N-benzyl-2-[(4-carbamoylphenyl)methoxy]benzamide
CID 17465507
2-[(4-fluorophenyl)methoxy]-N-(pyridin-3-ylmethyl)benzamide
CID 8851794
2-[(2-bromophenyl)methoxy]-N-[(4-fluorophenyl)methyl]benzamide
CID 7935492
2-[(4-fluorophenyl)methoxy]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide
CID 24551331
N-(2-amino-2-methylpropyl)-2-[(4-fluorophenyl)methoxy]benzamide;hydrochloride
CID 119626985
N-benzyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]benzamide
CID 7981561
2-[(4-fluorophenyl)methoxy]-N'-phenylbenzohydrazide
CID 78774963
2-[(4-fluorophenyl)methoxy]-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 55887151
N-[(4-acetamidophenyl)methyl]-2-(4-fluoroanilino)benzamide
CID 18153818
N-(2-fluorophenyl)-2-[(4-fluorophenyl)methoxy]benzamide
CID 26115053
methyl 4-[[2-(benzylcarbamoyl)phenoxy]methyl]benzoate
CID 7981645

Frequently Asked Questions

What is the IUPAC name of N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide?
The IUPAC name of N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide (CID 155947041) is N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide?
The canonical SMILES for N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide is NC(=O)Nc1ccc(CNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1.
What is the InChIKey of N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide?
The InChIKey is LEFBFHQGBHLVMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O3/c23-17-9-5-16(6-10-17)14-29-20-4-2-1-3-19(20)21(27)25-13-15-7-11-18(12-8-15)26-22(24)28/h1-12H,13-14H2,(H,25,27)(H3,24,26,28).
What are the key properties of N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide?
N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide has a molecular weight of 393.42 g/mol, XLogP of 3.83, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(carbamoylamino)phenyl]methyl]-2-[(4-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 155947041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).