N-(2-propan-2-ylphenyl)benzamide

C16H17NO — CID 723391

IUPACN-(2-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C16H17NO/c1-12(2)14-10-6-7-11-15(14)17-16(18)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18)
InChIKeyLWNRYWRKZPBSLL-UHFFFAOYSA-N
MW239.32 g/mol
LogP4.06
Rot. Bonds3

About N-(2-propan-2-ylphenyl)benzamide

N-(2-propan-2-ylphenyl)benzamide (PubChem CID 723391) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(2-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound NameN-(2-propan-2-ylphenyl)benzamide
PubChem CID723391
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC NameN-(2-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccccc1NC(=O)c1ccccc1
InChIInChI=1S/C16H17NO/c1-12(2)14-10-6-7-11-15(14)17-16(18)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18)
InChIKeyLWNRYWRKZPBSLL-UHFFFAOYSA-N
XLogP4.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(2-propan-2-ylphenyl)carbamoyl]benzoic acid
CID 43452749
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109043167
4-N-(2-fluorophenyl)-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049811
4-(methylamino)-N-(2-propan-2-ylphenyl)benzamide
CID 62185459
N-[2-[(2R)-butan-2-yl]phenyl]benzamide
CID 849169
3-chloro-N-(2-propan-2-ylphenyl)benzamide
CID 681881
3,5-diamino-N-(2-propan-2-ylphenyl)benzamide
CID 61092144
N-[2,6-di(propan-2-yl)phenyl]benzamide
CID 709320
4-N-(2-propan-2-ylphenyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 109042975
3-N-(1-phenylethyl)-1-N-(2-propan-2-ylphenyl)benzene-1,3-dicarboxamide
CID 109054468
4-(methanesulfonamido)-N-(2-propan-2-ylphenyl)benzamide
CID 51179900
N-[2,6-di(propan-2-yl)phenyl]benzamide;hydroiodide
CID 175991462

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylphenyl)benzamide?
The IUPAC name of N-(2-propan-2-ylphenyl)benzamide (CID 723391) is N-(2-propan-2-ylphenyl)benzamide.
What is the SMILES notation for N-(2-propan-2-ylphenyl)benzamide?
The canonical SMILES for N-(2-propan-2-ylphenyl)benzamide is CC(C)c1ccccc1NC(=O)c1ccccc1.
What is the InChIKey of N-(2-propan-2-ylphenyl)benzamide?
The InChIKey is LWNRYWRKZPBSLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-12(2)14-10-6-7-11-15(14)17-16(18)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18).
What are the key properties of N-(2-propan-2-ylphenyl)benzamide?
N-(2-propan-2-ylphenyl)benzamide has a molecular weight of 239.32 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 723391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).