2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide

C11H19N3O — CID 66405923

IUPAC2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide
SMILESCCNCc1ccn(CC(=O)N(C)C)c1
InChIInChI=1S/C11H19N3O/c1-4-12-7-10-5-6-14(8-10)9-11(15)13(2)3/h5-6,8,12H,4,7,9H2,1-3H3
InChIKeySUVJHXSSJPYJNA-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.69
Rot. Bonds5

About 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide

2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide (PubChem CID 66405923) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide
PubChem CID66405923
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide
SMILESCCNCc1ccn(CC(=O)N(C)C)c1
InChIInChI=1S/C11H19N3O/c1-4-12-7-10-5-6-14(8-10)9-11(15)13(2)3/h5-6,8,12H,4,7,9H2,1-3H3
InChIKeySUVJHXSSJPYJNA-UHFFFAOYSA-N
XLogP0.69
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide 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-[(1-ethylpyrrol-3-yl)methylamino]-N,N-dimethylacetamide
CID 66397768
N-cyclopropyl-2-[3-(ethylaminomethyl)pyrrol-1-yl]acetamide
CID 66406741
2-[3-[(tert-butylamino)methyl]pyrrol-1-yl]-N-ethyl-N-methylacetamide
CID 66406597
N-[(1-dodecylpyrrol-3-yl)methyl]ethanamine
CID 66404098
N-cyclopropyl-N-ethyl-2-[3-(methylaminomethyl)pyrrol-1-yl]acetamide
CID 66406717
N-ethyl-2-[3-[(2-methoxyethylamino)methyl]pyrrol-1-yl]acetamide
CID 66406838
2-[3-(aminomethyl)pyrrol-1-yl]-N,N-diethylacetamide
CID 66408410
N-cyclopropyl-3-[3-(ethylaminomethyl)pyrrol-1-yl]propanamide
CID 66404307
N-methyl-2-[3-(methylaminomethyl)pyrrol-1-yl]acetamide
CID 66404281
N-[[1-(oxan-4-ylmethyl)pyrrol-3-yl]methyl]ethanamine
CID 66406332
N-benzyl-2-[3-(propylaminomethyl)pyrrol-1-yl]acetamide
CID 66405734
ethyl 2-[(1-propylpyrrol-3-yl)methylamino]acetate
CID 66414373

Frequently Asked Questions

What is the IUPAC name of 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide (CID 66405923) is 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide is CCNCc1ccn(CC(=O)N(C)C)c1.
What is the InChIKey of 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide?
The InChIKey is SUVJHXSSJPYJNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-12-7-10-5-6-14(8-10)9-11(15)13(2)3/h5-6,8,12H,4,7,9H2,1-3H3.
What are the key properties of 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide?
2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide has a molecular weight of 209.29 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(ethylaminomethyl)pyrrol-1-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 66405923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).