N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

C23H32N2O4 — CID 55520450

IUPACN-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
SMILESCC(C)C(CNC(=O)COc1ccc2oc3c(c2c1)CCCC3)N1CCOCC1
InChIInChI=1S/C23H32N2O4/c1-16(2)20(25-9-11-27-12-10-25)14-24-23(26)15-28-17-7-8-22-19(13-17)18-5-3-4-6-21(18)29-22/h7-8,13,16,20H,3-6,9-12,14-15H2,1-2H3,(H,24,26)
InChIKeyVTWATNWGIINGMV-UHFFFAOYSA-N
MW400.52 g/mol
LogP3.16
Rot. Bonds7

About N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide

N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (PubChem CID 55520450) has the molecular formula C23H32N2O4 and a molecular weight of 400.52 g/mol. Its IUPAC name is N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.

Molecular Properties

Compound NameN-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
PubChem CID55520450
Molecular FormulaC23H32N2O4
Molecular Weight400.52 g/mol
Exact Mass400.24
IUPAC NameN-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
SMILESCC(C)C(CNC(=O)COc1ccc2oc3c(c2c1)CCCC3)N1CCOCC1
InChIInChI=1S/C23H32N2O4/c1-16(2)20(25-9-11-27-12-10-25)14-24-23(26)15-28-17-7-8-22-19(13-17)18-5-3-4-6-21(18)29-22/h7-8,13,16,20H,3-6,9-12,14-15H2,1-2H3,(H,24,26)
InChIKeyVTWATNWGIINGMV-UHFFFAOYSA-N
XLogP3.16
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.52
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide with MolForge

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Related Compounds

N-[2-(methylamino)propyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide;hydrochloride
CID 120827134
2-(4-bromophenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 18153802
N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 41247942
N-ethoxy-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 46536426
N-(6-morpholin-4-yl-3-pyridinyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 37274733
N-[1-(oxolan-2-yl)ethyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 43067366
2-(2,4-dimethylphenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 43067301
N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 56558264
2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)-N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)acetamide
CID 51185256
2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide
CID 41261420
N-(4-methoxyphenyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 3772122
N-(pyridin-2-ylmethyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 8880601

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The IUPAC name of N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide (CID 55520450) is N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide.
What is the SMILES notation for N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The canonical SMILES for N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is CC(C)C(CNC(=O)COc1ccc2oc3c(c2c1)CCCC3)N1CCOCC1.
What is the InChIKey of N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
The InChIKey is VTWATNWGIINGMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O4/c1-16(2)20(25-9-11-27-12-10-25)14-24-23(26)15-28-17-7-8-22-19(13-17)18-5-3-4-6-21(18)29-22/h7-8,13,16,20H,3-6,9-12,14-15H2,1-2H3,(H,24,26).
What are the key properties of N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide?
N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide has a molecular weight of 400.52 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-morpholin-4-ylbutyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide is sourced from PubChem (CID 55520450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).