N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide

C24H24N2O — CID 46546920

IUPACN-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide
SMILESO=C(NC1CCN(Cc2ccccc2)C1)c1ccccc1-c1ccccc1
InChIInChI=1S/C24H24N2O/c27-24(23-14-8-7-13-22(23)20-11-5-2-6-12-20)25-21-15-16-26(18-21)17-19-9-3-1-4-10-19/h1-14,21H,15-18H2,(H,25,27)
InChIKeyRSCIVJJFJJTWIU-UHFFFAOYSA-N
MW356.47 g/mol
LogP4.36
Rot. Bonds5

About N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide

N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide (PubChem CID 46546920) has the molecular formula C24H24N2O and a molecular weight of 356.47 g/mol. Its IUPAC name is N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide.

Molecular Properties

Compound NameN-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide
PubChem CID46546920
Molecular FormulaC24H24N2O
Molecular Weight356.47 g/mol
Exact Mass356.19
IUPAC NameN-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide
SMILESO=C(NC1CCN(Cc2ccccc2)C1)c1ccccc1-c1ccccc1
InChIInChI=1S/C24H24N2O/c27-24(23-14-8-7-13-22(23)20-11-5-2-6-12-20)25-21-15-16-26(18-21)17-19-9-3-1-4-10-19/h1-14,21H,15-18H2,(H,25,27)
InChIKeyRSCIVJJFJJTWIU-UHFFFAOYSA-N
XLogP4.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3S)-1-benzylpyrrolidin-3-yl]-2-(2-phenylphenoxy)acetamide
CID 41095172
N-(1-benzylpyrrolidin-3-yl)-5-chloro-2-fluorobenzamide
CID 18156432
N-[(3R)-1-benzylpyrrolidin-3-yl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 94172282
4-amino-N-(1-benzylpyrrolidin-3-yl)benzamide
CID 21330045
N-[1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]pyrrolidin-3-yl]-2-phenylbenzamide
CID 6710997
N-(1-benzylpyrrolidin-3-yl)-2,4-dimethylbenzamide
CID 18156319
N-(1-benzylpyrrolidin-3-yl)-2-bromofuran-3-carboxamide
CID 106853183
N-(1-benzylpiperidin-3-yl)-2-methylbenzamide
CID 42958722
N-(1-benzylpyrrolidin-3-yl)-2-hydroxy-4-methylbenzamide
CID 55376410
N-(1-benzylpyrrolidin-3-yl)-2-bromo-5-fluorobenzamide
CID 18156414
N-[(3S)-1-benzylpyrrolidin-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 95145261
N-[(3S)-1-benzylpyrrolidin-3-yl]-2-phenylsulfanylpyridine-3-carboxamide
CID 9118983

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide?
The IUPAC name of N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide (CID 46546920) is N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide.
What is the SMILES notation for N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide?
The canonical SMILES for N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide is O=C(NC1CCN(Cc2ccccc2)C1)c1ccccc1-c1ccccc1.
What is the InChIKey of N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide?
The InChIKey is RSCIVJJFJJTWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O/c27-24(23-14-8-7-13-22(23)20-11-5-2-6-12-20)25-21-15-16-26(18-21)17-19-9-3-1-4-10-19/h1-14,21H,15-18H2,(H,25,27).
What are the key properties of N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide?
N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide has a molecular weight of 356.47 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpyrrolidin-3-yl)-2-phenylbenzamide is sourced from PubChem (CID 46546920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).