4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide

C20H24N2O — CID 93157619

IUPAC4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
SMILESC[C@H](CNC(=O)c1ccc(-c2ccccc2)cc1)N1CCCC1
InChIInChI=1S/C20H24N2O/c1-16(22-13-5-6-14-22)15-21-20(23)19-11-9-18(10-12-19)17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-15H2,1H3,(H,21,23)/t16-/m1/s1
InChIKeyBYWOVHMCLUFGFJ-MRXNPFEDSA-N
MW308.43 g/mol
LogP3.57
Rot. Bonds5

About 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide

4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide (PubChem CID 93157619) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide.

Molecular Properties

Compound Name4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
PubChem CID93157619
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
SMILESC[C@H](CNC(=O)c1ccc(-c2ccccc2)cc1)N1CCCC1
InChIInChI=1S/C20H24N2O/c1-16(22-13-5-6-14-22)15-21-20(23)19-11-9-18(10-12-19)17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-15H2,1H3,(H,21,23)/t16-/m1/s1
InChIKeyBYWOVHMCLUFGFJ-MRXNPFEDSA-N
XLogP3.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-N-[(2S)-2-pyrrolidin-1-ylpropyl]benzamide
CID 93157618
3-phenyl-N-(2-piperidin-1-ylpropyl)benzamide
CID 112502353
4-chloro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47187389
N-(2-piperidin-1-ylpropyl)-4-pyrrol-1-ylbenzamide
CID 110301675
4-cyano-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47026894
N-(2-methylpropyl)-4-(4-phenylphenyl)benzamide
CID 145125410
4-phenyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide
CID 42917071
N-[2-(4-methylpiperidin-1-yl)propyl]benzamide
CID 112502434
N-(2-hydroxypropyl)-4-phenylbenzamide
CID 43391038
4-(3-hydroxy-3-methylbutyl)-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 95860893
N-[(2S)-2-pyrrolidin-1-ylpropyl]pyridine-3-carboxamide
CID 93157610
3-bromo-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide
CID 51710424

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide?
The IUPAC name of 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide (CID 93157619) is 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide.
What is the SMILES notation for 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide?
The canonical SMILES for 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide is C[C@H](CNC(=O)c1ccc(-c2ccccc2)cc1)N1CCCC1.
What is the InChIKey of 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide?
The InChIKey is BYWOVHMCLUFGFJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H24N2O/c1-16(22-13-5-6-14-22)15-21-20(23)19-11-9-18(10-12-19)17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-15H2,1H3,(H,21,23)/t16-/m1/s1.
What are the key properties of 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide?
4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide has a molecular weight of 308.43 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[(2R)-2-pyrrolidin-1-ylpropyl]benzamide is sourced from PubChem (CID 93157619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).