N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide

C15H20N2O4 — CID 66427021

IUPACN-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide
SMILESO=C(CC1CNCCO1)NCC1COc2ccccc2O1
InChIInChI=1S/C15H20N2O4/c18-15(7-11-8-16-5-6-19-11)17-9-12-10-20-13-3-1-2-4-14(13)21-12/h1-4,11-12,16H,5-10H2,(H,17,18)
InChIKeyDVEFSNDSVOVXQY-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.32
Rot. Bonds4

About N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide (PubChem CID 66427021) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide
PubChem CID66427021
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC NameN-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide
SMILESO=C(CC1CNCCO1)NCC1COc2ccccc2O1
InChIInChI=1S/C15H20N2O4/c18-15(7-11-8-16-5-6-19-11)17-9-12-10-20-13-3-1-2-4-14(13)21-12/h1-4,11-12,16H,5-10H2,(H,17,18)
InChIKeyDVEFSNDSVOVXQY-UHFFFAOYSA-N
XLogP0.32
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide
CID 7334544
3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]propanamide
CID 1251106
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidine-3-carboxamide
CID 61249148
N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
CID 114332328
3-amino-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)propanamide;hydrochloride
CID 119266203
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(methylamino)acetamide
CID 60686684
2-morpholin-2-yl-N-(2-phenylethyl)acetamide
CID 66434342
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(propylamino)acetamide
CID 60687691
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-4-ium-4-ylacetamide
CID 4051777
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-nitroacetamide
CID 108814523
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-piperidin-1-ium-1-ylacetamide
CID 4051778
N-(3,4-dihydro-2H-chromen-4-yl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119685157

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide (CID 66427021) is N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide is O=C(CC1CNCCO1)NCC1COc2ccccc2O1.
What is the InChIKey of N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide?
The InChIKey is DVEFSNDSVOVXQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c18-15(7-11-8-16-5-6-19-11)17-9-12-10-20-13-3-1-2-4-14(13)21-12/h1-4,11-12,16H,5-10H2,(H,17,18).
What are the key properties of N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide?
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide has a molecular weight of 292.33 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66427021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).