N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide

C15H22N2O4 — CID 61286331

IUPACN-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide
SMILESCOc1cc(N)ccc1NC(=O)CCOC1CCOCC1
InChIInChI=1S/C15H22N2O4/c1-19-14-10-11(16)2-3-13(14)17-15(18)6-9-21-12-4-7-20-8-5-12/h2-3,10,12H,4-9,16H2,1H3,(H,17,18)
InChIKeyMEVHNDQNEFBAGI-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.80
Rot. Bonds6

About N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide

N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide (PubChem CID 61286331) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide.

Molecular Properties

Compound NameN-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide
PubChem CID61286331
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC NameN-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide
SMILESCOc1cc(N)ccc1NC(=O)CCOC1CCOCC1
InChIInChI=1S/C15H22N2O4/c1-19-14-10-11(16)2-3-13(14)17-15(18)6-9-21-12-4-7-20-8-5-12/h2-3,10,12H,4-9,16H2,1H3,(H,17,18)
InChIKeyMEVHNDQNEFBAGI-UHFFFAOYSA-N
XLogP1.80
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)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

N-(4-amino-2-methoxyphenyl)-4-(oxolan-3-yloxy)butanamide
CID 63557411
N-(4-amino-2-methoxyphenyl)-3-(oxan-4-ylsulfanyl)propanamide
CID 62996070
N-(4-amino-2-methoxyphenyl)oxane-4-carboxamide
CID 53410709
N-(4-amino-2-methoxyphenyl)-2-(oxan-4-ylmethoxy)acetamide
CID 62381831
N-(4-amino-2-methoxyphenyl)-3-(oxolan-2-yl)propanamide
CID 65152231
N-(4-amino-2-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxy]propanamide
CID 28995288
N-(4-amino-2-methylphenyl)-2-(oxan-4-yloxy)acetamide
CID 61289356
N-(4-amino-2-methoxyphenyl)-2-(4-methylcyclohexyl)oxyacetamide
CID 18070790
N-(4-amino-2-methoxyphenyl)nonanamide
CID 65447968
N-(5-amino-2-methylphenyl)-3-cyclobutyloxypropanamide
CID 62116315
N-(4-aminophenyl)-4-(oxan-4-yloxy)butanamide
CID 61289162
N-(2-amino-4-methoxyphenyl)-2-(oxan-4-yloxy)acetamide
CID 61288778

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide?
The IUPAC name of N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide (CID 61286331) is N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide.
What is the SMILES notation for N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide?
The canonical SMILES for N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide is COc1cc(N)ccc1NC(=O)CCOC1CCOCC1.
What is the InChIKey of N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide?
The InChIKey is MEVHNDQNEFBAGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-19-14-10-11(16)2-3-13(14)17-15(18)6-9-21-12-4-7-20-8-5-12/h2-3,10,12H,4-9,16H2,1H3,(H,17,18).
What are the key properties of N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide?
N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide has a molecular weight of 294.35 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methoxyphenyl)-3-(oxan-4-yloxy)propanamide is sourced from PubChem (CID 61286331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).