N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide

C20H24N2O2 — CID 2301465

IUPACN-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide
SMILESCC(C)CNC(=O)c1cccc(NC(=O)CCc2ccccc2)c1
InChIInChI=1S/C20H24N2O2/c1-15(2)14-21-20(24)17-9-6-10-18(13-17)22-19(23)12-11-16-7-4-3-5-8-16/h3-10,13,15H,11-12,14H2,1-2H3,(H,21,24)(H,22,23)
InChIKeySWLRJJTZOMIQSO-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.64
Rot. Bonds7

About N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide

N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide (PubChem CID 2301465) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide
PubChem CID2301465
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide
SMILESCC(C)CNC(=O)c1cccc(NC(=O)CCc2ccccc2)c1
InChIInChI=1S/C20H24N2O2/c1-15(2)14-21-20(24)17-9-6-10-18(13-17)22-19(23)12-11-16-7-4-3-5-8-16/h3-10,13,15H,11-12,14H2,1-2H3,(H,21,24)(H,22,23)
InChIKeySWLRJJTZOMIQSO-UHFFFAOYSA-N
XLogP3.64
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide?
The IUPAC name of N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide (CID 2301465) is N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide.
What is the SMILES notation for N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide?
The canonical SMILES for N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide is CC(C)CNC(=O)c1cccc(NC(=O)CCc2ccccc2)c1.
What is the InChIKey of N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide?
The InChIKey is SWLRJJTZOMIQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15(2)14-21-20(24)17-9-6-10-18(13-17)22-19(23)12-11-16-7-4-3-5-8-16/h3-10,13,15H,11-12,14H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide?
N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide has a molecular weight of 324.42 g/mol, XLogP of 3.64, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-3-(3-phenylpropanoylamino)benzamide is sourced from PubChem (CID 2301465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).