N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide

C20H24N2O2 — CID 119691210

IUPACN-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide
SMILESCOc1ccc(N(Cc2ccccc2)C(=O)CC2CCCN2)cc1
InChIInChI=1S/C20H24N2O2/c1-24-19-11-9-18(10-12-19)22(15-16-6-3-2-4-7-16)20(23)14-17-8-5-13-21-17/h2-4,6-7,9-12,17,21H,5,8,13-15H2,1H3
InChIKeyJJCAPQMYCAVQHF-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.37
Rot. Bonds6

About N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide

N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide (PubChem CID 119691210) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide
PubChem CID119691210
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide
SMILESCOc1ccc(N(Cc2ccccc2)C(=O)CC2CCCN2)cc1
InChIInChI=1S/C20H24N2O2/c1-24-19-11-9-18(10-12-19)22(15-16-6-3-2-4-7-16)20(23)14-17-8-5-13-21-17/h2-4,6-7,9-12,17,21H,5,8,13-15H2,1H3
InChIKeyJJCAPQMYCAVQHF-UHFFFAOYSA-N
XLogP3.37
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-(4-methoxyphenyl)-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119935581
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 61363682
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119692035
methyl 2-[benzyl-(2-pyrrolidin-2-ylacetyl)amino]acetate
CID 61366041
N-benzyl-N-(4-methoxybutyl)-2-pyrrolidin-2-ylacetamide
CID 119752528
N-benzyl-N-(4-methoxybutyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119752527
2-amino-N-benzyl-N-(4-methoxyphenyl)acetamide;hydrochloride
CID 119032182
N-[1-(4-methoxyphenyl)ethyl]-N-methyl-2-pyrrolidin-2-ylacetamide
CID 119704713
N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119807499
N-benzyl-N-(4-methoxyphenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 119691200
1-N,3-N-dibenzyl-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 10144171
N-benzyl-N-(4-methoxyphenyl)hexanamide
CID 60594646

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide (CID 119691210) is N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide is COc1ccc(N(Cc2ccccc2)C(=O)CC2CCCN2)cc1.
What is the InChIKey of N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is JJCAPQMYCAVQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-24-19-11-9-18(10-12-19)22(15-16-6-3-2-4-7-16)20(23)14-17-8-5-13-21-17/h2-4,6-7,9-12,17,21H,5,8,13-15H2,1H3.
What are the key properties of N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide?
N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 324.42 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119691210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).