N-(2-methylprop-1-enyl)-2-phenylbenzamide

C17H17NO — CID 13217955

IUPACN-(2-methylprop-1-enyl)-2-phenylbenzamide
SMILESCC(C)=CNC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C17H17NO/c1-13(2)12-18-17(19)16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-12H,1-2H3,(H,18,19)
InChIKeyCUROBZAHSBFEOQ-UHFFFAOYSA-N
MW251.33 g/mol
LogP4.01
Rot. Bonds3

About N-(2-methylprop-1-enyl)-2-phenylbenzamide

N-(2-methylprop-1-enyl)-2-phenylbenzamide (PubChem CID 13217955) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is N-(2-methylprop-1-enyl)-2-phenylbenzamide.

Molecular Properties

Compound NameN-(2-methylprop-1-enyl)-2-phenylbenzamide
PubChem CID13217955
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC NameN-(2-methylprop-1-enyl)-2-phenylbenzamide
SMILESCC(C)=CNC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C17H17NO/c1-13(2)12-18-17(19)16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-12H,1-2H3,(H,18,19)
InChIKeyCUROBZAHSBFEOQ-UHFFFAOYSA-N
XLogP4.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylprop-1-enyl)-2-phenylbenzamide?
The IUPAC name of N-(2-methylprop-1-enyl)-2-phenylbenzamide (CID 13217955) is N-(2-methylprop-1-enyl)-2-phenylbenzamide.
What is the SMILES notation for N-(2-methylprop-1-enyl)-2-phenylbenzamide?
The canonical SMILES for N-(2-methylprop-1-enyl)-2-phenylbenzamide is CC(C)=CNC(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of N-(2-methylprop-1-enyl)-2-phenylbenzamide?
The InChIKey is CUROBZAHSBFEOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-13(2)12-18-17(19)16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-12H,1-2H3,(H,18,19).
What are the key properties of N-(2-methylprop-1-enyl)-2-phenylbenzamide?
N-(2-methylprop-1-enyl)-2-phenylbenzamide has a molecular weight of 251.33 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-1-enyl)-2-phenylbenzamide is sourced from PubChem (CID 13217955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).