2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine

C15H22N2O3 — CID 129284277

IUPAC2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine
SMILESCOCC1(C)Cc2cc(N)c(N3CCOCC3)cc2O1
InChIInChI=1S/C15H22N2O3/c1-15(10-18-2)9-11-7-12(16)13(8-14(11)20-15)17-3-5-19-6-4-17/h7-8H,3-6,9-10,16H2,1-2H3
InChIKeyUEMIFNWRIAGQFR-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.45
Rot. Bonds3

About 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine

2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine (PubChem CID 129284277) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine
PubChem CID129284277
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine
SMILESCOCC1(C)Cc2cc(N)c(N3CCOCC3)cc2O1
InChIInChI=1S/C15H22N2O3/c1-15(10-18-2)9-11-7-12(16)13(8-14(11)20-15)17-3-5-19-6-4-17/h7-8H,3-6,9-10,16H2,1-2H3
InChIKeyUEMIFNWRIAGQFR-UHFFFAOYSA-N
XLogP1.45
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(5-amino-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-2-yl)ethanol
CID 129284216
2-cyclopropyl-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine
CID 129284594
[2-(difluoromethoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]-dioxidoazanium
CID 163510447
2-(2-methyl-6-morpholin-4-yl-5-nitroso-3H-1-benzofuran-2-yl)ethanol
CID 129298671
2,2-dimethyl-6-pyrrolidin-1-yl-3H-1-benzofuran-5-amine
CID 129298388
N,2,2-trimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine
CID 167038773
[5-amino-2-methyl-6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]-3H-1-benzofuran-2-yl]methanol
CID 129298445
[1-(5-amino-2,2-dimethyl-3H-1-benzofuran-6-yl)-4-fluoropiperidin-4-yl]methanol
CID 129284480
methoxy-(1'-methyl-6-morpholin-4-ylspiro[3H-1-benzofuran-2,4'-piperidine]-5-yl)-oxoazanium
CID 166004635
4-amino-5-[amino(methyl)amino]-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]pyridine-3-carboxamide
CID 167038748
4-methyl-5-morpholin-4-ylbenzene-1,2-diamine
CID 54371307
5-methyl-2-morpholin-4-ylaniline
CID 18952141

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine?
The IUPAC name of 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine (CID 129284277) is 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine.
What is the SMILES notation for 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine?
The canonical SMILES for 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine is COCC1(C)Cc2cc(N)c(N3CCOCC3)cc2O1.
What is the InChIKey of 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine?
The InChIKey is UEMIFNWRIAGQFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-15(10-18-2)9-11-7-12(16)13(8-14(11)20-15)17-3-5-19-6-4-17/h7-8H,3-6,9-10,16H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine?
2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine has a molecular weight of 278.35 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-amine is sourced from PubChem (CID 129284277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).