2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide

C14H20N2O3 — CID 119452551

IUPAC2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide
SMILESCOc1cccc(OC)c1CC(=O)NC1CCNC1
InChIInChI=1S/C14H20N2O3/c1-18-12-4-3-5-13(19-2)11(12)8-14(17)16-10-6-7-15-9-10/h3-5,10,15H,6-9H2,1-2H3,(H,16,17)
InChIKeyWVOPSVJMFZMFNO-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.72
Rot. Bonds5

About 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide

2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide (PubChem CID 119452551) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound Name2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide
PubChem CID119452551
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide
SMILESCOc1cccc(OC)c1CC(=O)NC1CCNC1
InChIInChI=1S/C14H20N2O3/c1-18-12-4-3-5-13(19-2)11(12)8-14(17)16-10-6-7-15-9-10/h3-5,10,15H,6-9H2,1-2H3,(H,16,17)
InChIKeyWVOPSVJMFZMFNO-UHFFFAOYSA-N
XLogP0.72
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methoxyphenyl)-3-methyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119449852
2-(2-propan-2-yloxyphenyl)-N-pyrrolidin-3-ylacetamide
CID 119450481
2-phenyl-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688083
2-(2-methoxyphenoxy)-N-piperidin-4-ylacetamide
CID 28810945
2-(2-chloro-6-fluorophenyl)-N-pyrrolidin-3-ylacetamide
CID 55068411
2-(2-chloro-6-methoxyphenyl)-N-cyclohexylacetamide
CID 69037841
2-hydroxy-3-methoxy-N-piperidin-3-ylbenzamide
CID 24708250
2-(2,6-dimethoxyphenyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]acetamide;hydrochloride
CID 120943517
3-(3,4-dimethoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119453910
2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
CID 43603662
3-(2,3-dimethylphenoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119454143
2-(3-methoxyphenyl)sulfanyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119453540

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide?
The IUPAC name of 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide (CID 119452551) is 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide is COc1cccc(OC)c1CC(=O)NC1CCNC1.
What is the InChIKey of 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide?
The InChIKey is WVOPSVJMFZMFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-18-12-4-3-5-13(19-2)11(12)8-14(17)16-10-6-7-15-9-10/h3-5,10,15H,6-9H2,1-2H3,(H,16,17).
What are the key properties of 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide?
2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide has a molecular weight of 264.32 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethoxyphenyl)-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 119452551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).