N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide

C20H24N2O — CID 35180369

IUPACN-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
SMILESCc1ccc([C@H](CNC(=O)c2ccccc2)N2CCCC2)cc1
InChIInChI=1S/C20H24N2O/c1-16-9-11-17(12-10-16)19(22-13-5-6-14-22)15-21-20(23)18-7-3-2-4-8-18/h2-4,7-12,19H,5-6,13-15H2,1H3,(H,21,23)/t19-/m0/s1
InChIKeyDORSJNADSFCFJJ-IBGZPJMESA-N
MW308.43 g/mol
LogP3.56
Rot. Bonds5

About N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide

N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide (PubChem CID 35180369) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
PubChem CID35180369
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
SMILESCc1ccc([C@H](CNC(=O)c2ccccc2)N2CCCC2)cc1
InChIInChI=1S/C20H24N2O/c1-16-9-11-17(12-10-16)19(22-13-5-6-14-22)15-21-20(23)18-7-3-2-4-8-18/h2-4,7-12,19H,5-6,13-15H2,1H3,(H,21,23)/t19-/m0/s1
InChIKeyDORSJNADSFCFJJ-IBGZPJMESA-N
XLogP3.56
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 ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 43842823
3-methyl-N-(2-phenyl-2-piperidin-1-ylethyl)benzamide
CID 45155327
4-fluoro-N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ylethyl]benzamide
CID 34951585
N-[(2S)-2-(4-chlorophenyl)-2-piperidin-1-ylethyl]-4-methylbenzamide
CID 40782504
N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]-2-phenylacetamide
CID 43843128
N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]-4-pyrrol-1-ylbenzamide
CID 110302906
N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ylethyl]-2-phenylacetamide
CID 34952082
3-chloro-N-[2-(4-methylphenyl)-2-piperidin-1-ylethyl]benzamide
CID 17011556
N-[(2R)-2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-4-methoxybenzamide
CID 34954942
3-methoxy-N-[(2S)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide
CID 35133193
2-chloro-N-[2-(4-methylphenyl)-2-piperidin-1-ylethyl]benzamide
CID 17011550
N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-2-chlorobenzamide;hydrochloride
CID 52984776

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide?
The IUPAC name of N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide (CID 35180369) is N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide.
What is the SMILES notation for N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide?
The canonical SMILES for N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide is Cc1ccc([C@H](CNC(=O)c2ccccc2)N2CCCC2)cc1.
What is the InChIKey of N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide?
The InChIKey is DORSJNADSFCFJJ-IBGZPJMESA-N. The full InChI is InChI=1S/C20H24N2O/c1-16-9-11-17(12-10-16)19(22-13-5-6-14-22)15-21-20(23)18-7-3-2-4-8-18/h2-4,7-12,19H,5-6,13-15H2,1H3,(H,21,23)/t19-/m0/s1.
What are the key properties of N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide?
N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide has a molecular weight of 308.43 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]benzamide is sourced from PubChem (CID 35180369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).