N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide

C17H26N2O — CID 119775261

IUPACN-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide
SMILESCc1ccc(C(C)(C)CNC(=O)CC2CCCN2)cc1
InChIInChI=1S/C17H26N2O/c1-13-6-8-14(9-7-13)17(2,3)12-19-16(20)11-15-5-4-10-18-15/h6-9,15,18H,4-5,10-12H2,1-3H3,(H,19,20)
InChIKeyNBCBXEQMPHSVJM-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.53
Rot. Bonds5

About N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide

N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 119775261) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide
PubChem CID119775261
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide
SMILESCc1ccc(C(C)(C)CNC(=O)CC2CCCN2)cc1
InChIInChI=1S/C17H26N2O/c1-13-6-8-14(9-7-13)17(2,3)12-19-16(20)11-15-5-4-10-18-15/h6-9,15,18H,4-5,10-12H2,1-3H3,(H,19,20)
InChIKeyNBCBXEQMPHSVJM-UHFFFAOYSA-N
XLogP2.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-bromophenyl)-2-methylpropyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119733957
N-[2-methyl-2-(3-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide
CID 119757018
N-[2-methyl-2-[4-(2-methylpropoxy)phenyl]propyl]-2-pyrrolidin-2-ylacetamide
CID 119778688
N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119760103
N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide
CID 119318660
N-[(4-tert-butylphenyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 119707437
N-[3-(4-methylphenoxy)propyl]-2-pyrrolidin-2-ylacetamide
CID 119757273
N-[(2,5-dimethylphenyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 115160160
2-pyrrolidin-2-yl-N-(2,2,4-trimethylpentyl)acetamide
CID 115160242
N-[[4-methyl-2-[(2-methylpropan-2-yl)oxy]phenyl]methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119811513
2-(methylamino)-N-[2-methyl-2-(4-methylphenyl)propyl]acetamide
CID 115152154
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119828479

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide (CID 119775261) is N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide is Cc1ccc(C(C)(C)CNC(=O)CC2CCCN2)cc1.
What is the InChIKey of N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is NBCBXEQMPHSVJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13-6-8-14(9-7-13)17(2,3)12-19-16(20)11-15-5-4-10-18-15/h6-9,15,18H,4-5,10-12H2,1-3H3,(H,19,20).
What are the key properties of N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide?
N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 274.41 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119775261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).