3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide

C20H24N2O2 — CID 960500

IUPAC3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2ccccc2N2CCCC2)c1
InChIInChI=1S/C20H24N2O2/c1-15(2)24-17-9-7-8-16(14-17)20(23)21-18-10-3-4-11-19(18)22-12-5-6-13-22/h3-4,7-11,14-15H,5-6,12-13H2,1-2H3,(H,21,23)
InChIKeyTXMAZYSEFNPASB-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.33
Rot. Bonds5

About 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide

3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide (PubChem CID 960500) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide.

Molecular Properties

Compound Name3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
PubChem CID960500
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2ccccc2N2CCCC2)c1
InChIInChI=1S/C20H24N2O2/c1-15(2)24-17-9-7-8-16(14-17)20(23)21-18-10-3-4-11-19(18)22-12-5-6-13-22/h3-4,7-11,14-15H,5-6,12-13H2,1-2H3,(H,21,23)
InChIKeyTXMAZYSEFNPASB-UHFFFAOYSA-N
XLogP4.33
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(4-acetylpiperazin-1-yl)phenyl]-3-propan-2-yloxybenzamide
CID 3161440
N-[5-amino-2-(4-methylpiperazin-1-yl)phenyl]-3-propan-2-yloxybenzamide
CID 91675880
3-iodo-N-(2-piperidin-1-ylphenyl)benzamide
CID 4501683
N-[2-(azepan-1-yl)phenyl]benzamide
CID 24652732
4-butan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 3584037
N-(2-cyanophenyl)-3-propan-2-yloxybenzamide
CID 924558
3,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 7492197
N-(2-tert-butylphenyl)-3-propan-2-yloxybenzamide
CID 8779118
N-(2-piperidin-1-ylphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide
CID 60560100
3,4-dichloro-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 960458
3-(dimethylsulfamoyl)-N-(2-piperidin-1-ylphenyl)benzamide
CID 2426815
ethyl 4-morpholin-4-yl-3-[(3-propan-2-yloxybenzoyl)amino]benzoate
CID 16740402

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide?
The IUPAC name of 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide (CID 960500) is 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide.
What is the SMILES notation for 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide?
The canonical SMILES for 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide is CC(C)Oc1cccc(C(=O)Nc2ccccc2N2CCCC2)c1.
What is the InChIKey of 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide?
The InChIKey is TXMAZYSEFNPASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15(2)24-17-9-7-8-16(14-17)20(23)21-18-10-3-4-11-19(18)22-12-5-6-13-22/h3-4,7-11,14-15H,5-6,12-13H2,1-2H3,(H,21,23).
What are the key properties of 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide?
3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide has a molecular weight of 324.42 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide is sourced from PubChem (CID 960500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).