N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide

C20H23NO2 — CID 169094515

IUPACN-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide
SMILESCC(C)Cc1ccc(C(C)C(=O)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C20H23NO2/c1-14(2)13-16-9-11-17(12-10-16)15(3)19(22)21-20(23)18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,21,22,23)
InChIKeyITLSQPSLGTXMEZ-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.95
Rot. Bonds5

About N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide

N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide (PubChem CID 169094515) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide.

Molecular Properties

Compound NameN-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide
PubChem CID169094515
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC NameN-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide
SMILESCC(C)Cc1ccc(C(C)C(=O)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C20H23NO2/c1-14(2)13-16-9-11-17(12-10-16)15(3)19(22)21-20(23)18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,21,22,23)
InChIKeyITLSQPSLGTXMEZ-UHFFFAOYSA-N
XLogP3.95
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide?
The IUPAC name of N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide (CID 169094515) is N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide.
What is the SMILES notation for N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide?
The canonical SMILES for N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide is CC(C)Cc1ccc(C(C)C(=O)NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide?
The InChIKey is ITLSQPSLGTXMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-14(2)13-16-9-11-17(12-10-16)15(3)19(22)21-20(23)18-7-5-4-6-8-18/h4-12,14-15H,13H2,1-3H3,(H,21,22,23).
What are the key properties of N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide?
N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide has a molecular weight of 309.41 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-methylpropyl)phenyl]propanoyl]benzamide is sourced from PubChem (CID 169094515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).