2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide

C12H23N3O4 — CID 81083241

IUPAC2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
SMILESCOCC(=O)N1CCC(NC(=O)C(N)COC)CC1
InChIInChI=1S/C12H23N3O4/c1-18-7-10(13)12(17)14-9-3-5-15(6-4-9)11(16)8-19-2/h9-10H,3-8,13H2,1-2H3,(H,14,17)
InChIKeyAPIVZDAPWRIQJF-UHFFFAOYSA-N
MW273.33 g/mol
LogP-1.29
Rot. Bonds6

About 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide

2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide (PubChem CID 81083241) has the molecular formula C12H23N3O4 and a molecular weight of 273.33 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
PubChem CID81083241
Molecular FormulaC12H23N3O4
Molecular Weight273.33 g/mol
Exact Mass273.17
IUPAC Name2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
SMILESCOCC(=O)N1CCC(NC(=O)C(N)COC)CC1
InChIInChI=1S/C12H23N3O4/c1-18-7-10(13)12(17)14-9-3-5-15(6-4-9)11(16)8-19-2/h9-10H,3-8,13H2,1-2H3,(H,14,17)
InChIKeyAPIVZDAPWRIQJF-UHFFFAOYSA-N
XLogP-1.29
TPSA93.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide 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-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
CID 43711839
2-amino-3-methoxy-N-[1-(3-phenylpropanoyl)piperidin-4-yl]propanamide;hydrochloride
CID 120986204
4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103497433
N-[1-(2-amino-3-methoxypropanoyl)piperidin-4-yl]-2-methylpropanamide
CID 81083203
2-amino-N-cyclooctyl-3-methoxypropanamide
CID 81082114
2-methoxy-1-[4-(propan-2-ylamino)piperidin-1-yl]ethanone
CID 43747632
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-methylpropanamide
CID 61266193
2-bromo-N-[1-(2-methoxyacetyl)piperidin-4-yl]acetamide
CID 63681407
4-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-methylbutanamide
CID 81076250
1-[4-(1-aminopropan-2-ylamino)piperidin-1-yl]-2-methoxyethanone
CID 103388974
1-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]cyclobutane-1-carboxamide
CID 81178645
2-amino-3-methoxy-N-[1-(2-phenylbutanoyl)piperidin-4-yl]propanamide
CID 120988219

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
The IUPAC name of 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide (CID 81083241) is 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
The canonical SMILES for 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide is COCC(=O)N1CCC(NC(=O)C(N)COC)CC1.
What is the InChIKey of 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
The InChIKey is APIVZDAPWRIQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O4/c1-18-7-10(13)12(17)14-9-3-5-15(6-4-9)11(16)8-19-2/h9-10H,3-8,13H2,1-2H3,(H,14,17).
What are the key properties of 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide?
2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide has a molecular weight of 273.33 g/mol, XLogP of -1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 81083241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).