N-tert-butyl-2-phenylmethoxybenzamide

C18H21NO2 — CID 4946348

IUPACN-tert-butyl-2-phenylmethoxybenzamide
SMILESCC(C)(C)NC(=O)c1ccccc1OCc1ccccc1
InChIInChI=1S/C18H21NO2/c1-18(2,3)19-17(20)15-11-7-8-12-16(15)21-13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,19,20)
InChIKeyVYMPAUFABPVKSW-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.79
Rot. Bonds4

About N-tert-butyl-2-phenylmethoxybenzamide

N-tert-butyl-2-phenylmethoxybenzamide (PubChem CID 4946348) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-tert-butyl-2-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-tert-butyl-2-phenylmethoxybenzamide
PubChem CID4946348
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-tert-butyl-2-phenylmethoxybenzamide
SMILESCC(C)(C)NC(=O)c1ccccc1OCc1ccccc1
InChIInChI=1S/C18H21NO2/c1-18(2,3)19-17(20)15-11-7-8-12-16(15)21-13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,19,20)
InChIKeyVYMPAUFABPVKSW-UHFFFAOYSA-N
XLogP3.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(2,2-dimethylpropanoyl)-2-phenylmethoxybenzohydrazide
CID 4938113
N'-benzoyl-2-phenylmethoxybenzohydrazide
CID 4938014
2-phenylmethoxy-N-(propan-2-ylideneamino)benzamide
CID 5200532
2-[(4-chlorophenyl)methoxy]-N-(2-methylbutan-2-yl)benzamide
CID 2115327
N-benzyl-2-[[4-[[2-(benzylcarbamoyl)phenoxy]methyl]phenyl]methoxy]benzamide
CID 101339913
2-butoxy-N'-(2-phenylmethoxybenzoyl)benzohydrazide
CID 4941310
dimethyl (E)-2,3-bis(2-phenylmethoxyphenyl)but-2-enedioate
CID 135020990
2-phenylmethoxybenzoyl chloride
CID 10999355
(2S,3R)-3-hydroxy-2-[(2-phenylmethoxybenzoyl)amino]butanoic acid
CID 54368898
2-phenylmethoxy-N-(2-phenylpropyl)benzamide
CID 133164529
N-tert-butyl-2-(2-phenylacetyl)benzamide
CID 15197823
(E)-4-oxo-4-[2-(2-phenylmethoxybenzoyl)hydrazinyl]but-2-enoic acid
CID 6234396

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-phenylmethoxybenzamide?
The IUPAC name of N-tert-butyl-2-phenylmethoxybenzamide (CID 4946348) is N-tert-butyl-2-phenylmethoxybenzamide.
What is the SMILES notation for N-tert-butyl-2-phenylmethoxybenzamide?
The canonical SMILES for N-tert-butyl-2-phenylmethoxybenzamide is CC(C)(C)NC(=O)c1ccccc1OCc1ccccc1.
What is the InChIKey of N-tert-butyl-2-phenylmethoxybenzamide?
The InChIKey is VYMPAUFABPVKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-18(2,3)19-17(20)15-11-7-8-12-16(15)21-13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,19,20).
What are the key properties of N-tert-butyl-2-phenylmethoxybenzamide?
N-tert-butyl-2-phenylmethoxybenzamide has a molecular weight of 283.37 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-phenylmethoxybenzamide is sourced from PubChem (CID 4946348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).