2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide

C15H22N2O2 — CID 119514519

IUPAC2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide
SMILESCc1cccc(C)c1OCC(=O)NCC1CCCN1
InChIInChI=1S/C15H22N2O2/c1-11-5-3-6-12(2)15(11)19-10-14(18)17-9-13-7-4-8-16-13/h3,5-6,13,16H,4,7-10H2,1-2H3,(H,17,18)
InChIKeyWIJBNKDCKJZEAE-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.55
Rot. Bonds5

About 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide

2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide (PubChem CID 119514519) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide
PubChem CID119514519
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide
SMILESCc1cccc(C)c1OCC(=O)NCC1CCCN1
InChIInChI=1S/C15H22N2O2/c1-11-5-3-6-12(2)15(11)19-10-14(18)17-9-13-7-4-8-16-13/h3,5-6,13,16H,4,7-10H2,1-2H3,(H,17,18)
InChIKeyWIJBNKDCKJZEAE-UHFFFAOYSA-N
XLogP1.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,6-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119464381
2-(2-ethoxyphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide;hydrochloride
CID 119511064
N-[2-(2,6-dimethylphenoxy)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119734952
2-(2-ethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 119510399
2-(2-methylphenyl)-N-(pyrrolidin-2-ylmethyl)acetamide;hydrochloride
CID 119260437
3-(2-methylphenyl)-N-(pyrrolidin-2-ylmethyl)propanamide;hydrochloride
CID 119513702
2-(5-methyl-2-propan-2-ylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 119511055
2-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)acetamide
CID 112701289
2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide
CID 94219466
2-chloro-6-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]benzamide
CID 91841478
2-(2,6-dimethylphenoxy)-N-[1,1,2,2-tetradeuterio-2-[[2-(2,6-dimethylphenoxy)acetyl]amino]ethyl]acetamide
CID 171381792
3-(3,4-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)propanamide
CID 119514495

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide (CID 119514519) is 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide is Cc1cccc(C)c1OCC(=O)NCC1CCCN1.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide?
The InChIKey is WIJBNKDCKJZEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-5-3-6-12(2)15(11)19-10-14(18)17-9-13-7-4-8-16-13/h3,5-6,13,16H,4,7-10H2,1-2H3,(H,17,18).
What are the key properties of 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide?
2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide is sourced from PubChem (CID 119514519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).