2,5-dimethyl-N-phenylmethoxybenzamide

C16H17NO2 — CID 9227271

IUPAC2,5-dimethyl-N-phenylmethoxybenzamide
SMILESCc1ccc(C)c(C(=O)NOCc2ccccc2)c1
InChIInChI=1S/C16H17NO2/c1-12-8-9-13(2)15(10-12)16(18)17-19-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyUFDZOYNFKAUKAN-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.17
Rot. Bonds4

About 2,5-dimethyl-N-phenylmethoxybenzamide

2,5-dimethyl-N-phenylmethoxybenzamide (PubChem CID 9227271) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 2,5-dimethyl-N-phenylmethoxybenzamide.

Molecular Properties

Compound Name2,5-dimethyl-N-phenylmethoxybenzamide
PubChem CID9227271
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name2,5-dimethyl-N-phenylmethoxybenzamide
SMILESCc1ccc(C)c(C(=O)NOCc2ccccc2)c1
InChIInChI=1S/C16H17NO2/c1-12-8-9-13(2)15(10-12)16(18)17-19-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyUFDZOYNFKAUKAN-UHFFFAOYSA-N
XLogP3.17
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-bromo-5-methyl-N-phenylmethoxybenzamide
CID 80962365
2-(2,5-dimethylphenyl)-N-phenylmethoxyacetamide
CID 63102778
N-[(4-methylphenyl)methoxy]benzamide
CID 2366824
2,5-dimethyl-1-phenyl-N-phenylmethoxypyrrole-3-carboxamide
CID 32577143
2-(2,5-dimethylphenyl)sulfanyl-N-phenylmethoxyacetamide
CID 32577082
2,5-dimethyl-N-(3-phenylpropyl)benzamide
CID 2202785
4,5-dimethyl-N-phenylmethoxythiophene-2-carboxamide
CID 32581114
2-methyl-N-[2-oxo-2-(phenylmethoxyamino)ethyl]benzamide
CID 51220307
2,5-dichloro-N-phenylmethoxythiophene-3-carboxamide
CID 41450667
3-methyl-N-phenylmethoxythiophene-2-carboxamide
CID 30796107
2,5-dimethyl-N-phenylmethoxyaniline
CID 88670805
benzyl 2,4-dimethylbenzoate;dihydrochloride
CID 156703415

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-phenylmethoxybenzamide?
The IUPAC name of 2,5-dimethyl-N-phenylmethoxybenzamide (CID 9227271) is 2,5-dimethyl-N-phenylmethoxybenzamide.
What is the SMILES notation for 2,5-dimethyl-N-phenylmethoxybenzamide?
The canonical SMILES for 2,5-dimethyl-N-phenylmethoxybenzamide is Cc1ccc(C)c(C(=O)NOCc2ccccc2)c1.
What is the InChIKey of 2,5-dimethyl-N-phenylmethoxybenzamide?
The InChIKey is UFDZOYNFKAUKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12-8-9-13(2)15(10-12)16(18)17-19-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,17,18).
What are the key properties of 2,5-dimethyl-N-phenylmethoxybenzamide?
2,5-dimethyl-N-phenylmethoxybenzamide has a molecular weight of 255.32 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-phenylmethoxybenzamide is sourced from PubChem (CID 9227271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).