4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide

C12H25N3O2 — CID 103155857

IUPAC4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
SMILESCOC(CN)CC(=O)N(C)CCN1CCCC1
InChIInChI=1S/C12H25N3O2/c1-14(7-8-15-5-3-4-6-15)12(16)9-11(10-13)17-2/h11H,3-10,13H2,1-2H3
InChIKeyZRHLZYNCJJQGTK-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.10
Rot. Bonds7

About 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide

4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide (PubChem CID 103155857) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide.

Molecular Properties

Compound Name4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
PubChem CID103155857
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide
SMILESCOC(CN)CC(=O)N(C)CCN1CCCC1
InChIInChI=1S/C12H25N3O2/c1-14(7-8-15-5-3-4-6-15)12(16)9-11(10-13)17-2/h11H,3-10,13H2,1-2H3
InChIKeyZRHLZYNCJJQGTK-UHFFFAOYSA-N
XLogP-0.10
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide 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

4-Methoxypyrrolidin-2-one
CID 22627013
4-amino-N-[2-(dimethylamino)-2-oxoethyl]-3-methoxy-N-(2,2,2-trifluoroethyl)butanamide
CID 103155176
(4-Methoxy-2-oxopyrrolidin-1-yl)ethanimidic acid
CID 13202143
(2S,3R)-2-amino-3-ethoxy-1-pyrrolidin-1-ylbutan-1-one
CID 20640640
(2S,3R)-2-amino-3-methoxy-1-pyrrolidin-1-ylbutan-1-one
CID 20640642
2-Amino-3-methoxy-1-pyrrolidin-1-ylbutan-1-one
CID 21252066
2-Amino-3-ethoxy-1-pyrrolidin-1-ylbutan-1-one
CID 21252072
(4R)-4-[(2S)-pentan-2-yl]oxypyrrolidin-2-one
CID 57229408
5-[2-(4-Methylpiperazin-1-yl)-2-oxoethyl]-1,3-oxazolidin-2-one
CID 57781806
1-(3-Aminopropanoyl)-4-methoxypyrrolidin-2-one
CID 58475186
N-methyl-N-[2-(methylamino)ethyl]-2-morpholin-2-ylacetamide
CID 66429182
2-Morpholin-2-yl-1-pyrrolidin-1-ylethanone
CID 66435303

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide?
The IUPAC name of 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide (CID 103155857) is 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide.
What is the SMILES notation for 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide?
The canonical SMILES for 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide is COC(CN)CC(=O)N(C)CCN1CCCC1.
What is the InChIKey of 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide?
The InChIKey is ZRHLZYNCJJQGTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-14(7-8-15-5-3-4-6-15)12(16)9-11(10-13)17-2/h11H,3-10,13H2,1-2H3.
What are the key properties of 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide?
4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide has a molecular weight of 243.35 g/mol, XLogP of -0.10, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)butanamide is sourced from PubChem (CID 103155857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).