4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide

C17H27N3O3 — CID 120595532

IUPAC4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide
SMILESCOC(CN)CC(=O)NCC(c1ccccc1)N1CCOCC1
InChIInChI=1S/C17H27N3O3/c1-22-15(12-18)11-17(21)19-13-16(14-5-3-2-4-6-14)20-7-9-23-10-8-20/h2-6,15-16H,7-13,18H2,1H3,(H,19,21)
InChIKeyDVMITLSWMVGWMW-UHFFFAOYSA-N
MW321.42 g/mol
LogP0.54
Rot. Bonds8

About 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide

4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide (PubChem CID 120595532) has the molecular formula C17H27N3O3 and a molecular weight of 321.42 g/mol. Its IUPAC name is 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide.

Molecular Properties

Compound Name4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide
PubChem CID120595532
Molecular FormulaC17H27N3O3
Molecular Weight321.42 g/mol
Exact Mass321.21
IUPAC Name4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide
SMILESCOC(CN)CC(=O)NCC(c1ccccc1)N1CCOCC1
InChIInChI=1S/C17H27N3O3/c1-22-15(12-18)11-17(21)19-13-16(14-5-3-2-4-6-14)20-7-9-23-10-8-20/h2-6,15-16H,7-13,18H2,1H3,(H,19,21)
InChIKeyDVMITLSWMVGWMW-UHFFFAOYSA-N
XLogP0.54
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)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-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-3-methoxybutanamide
CID 120596042
(2S)-2-amino-3,3-dimethyl-N-(2-morpholin-4-yl-2-phenylethyl)butanamide
CID 119853237
2-amino-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 119859927
N-[2-[4-(dimethylamino)phenyl]-2-morpholin-4-ylethyl]-3-phenylbutanamide
CID 110420650
2-benzhydryloxy-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
CID 55358314
3-(2-amino-2-oxoethyl)sulfanyl-N-(2-morpholin-4-yl-2-phenylethyl)propanamide
CID 43057620
N-[(2S)-2-morpholin-4-yl-2-(4-propan-2-ylphenyl)ethyl]-2-phenoxyacetamide
CID 35578113
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 43006637
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,2-diphenylacetamide
CID 2467575
N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-phenoxyacetamide
CID 112503607
N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 46569876
1-[(2S)-2-morpholin-4-yl-2-phenylethyl]-3-[(1R)-1-phenylethyl]urea
CID 51934988

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide?
The IUPAC name of 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide (CID 120595532) is 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide.
What is the SMILES notation for 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide?
The canonical SMILES for 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide is COC(CN)CC(=O)NCC(c1ccccc1)N1CCOCC1.
What is the InChIKey of 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide?
The InChIKey is DVMITLSWMVGWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3/c1-22-15(12-18)11-17(21)19-13-16(14-5-3-2-4-6-14)20-7-9-23-10-8-20/h2-6,15-16H,7-13,18H2,1H3,(H,19,21).
What are the key properties of 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide?
4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide has a molecular weight of 321.42 g/mol, XLogP of 0.54, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)butanamide is sourced from PubChem (CID 120595532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).