N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide

C16H19NO3 — CID 18782978

IUPACN-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide
SMILESCC(=O)N(C)CCc1coc2ccc3c(c12)CCCO3
InChIInChI=1S/C16H19NO3/c1-11(18)17(2)8-7-12-10-20-15-6-5-14-13(16(12)15)4-3-9-19-14/h5-6,10H,3-4,7-9H2,1-2H3
InChIKeyCOEIQDDBGCDZGL-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.78
Rot. Bonds3

About N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide

N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide (PubChem CID 18782978) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide
PubChem CID18782978
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide
SMILESCC(=O)N(C)CCc1coc2ccc3c(c12)CCCO3
InChIInChI=1S/C16H19NO3/c1-11(18)17(2)8-7-12-10-20-15-6-5-14-13(16(12)15)4-3-9-19-14/h5-6,10H,3-4,7-9H2,1-2H3
InChIKeyCOEIQDDBGCDZGL-UHFFFAOYSA-N
XLogP2.78
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide?
The IUPAC name of N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide (CID 18782978) is N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide.
What is the SMILES notation for N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide?
The canonical SMILES for N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide is CC(=O)N(C)CCc1coc2ccc3c(c12)CCCO3.
What is the InChIKey of N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide?
The InChIKey is COEIQDDBGCDZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-11(18)17(2)8-7-12-10-20-15-6-5-14-13(16(12)15)4-3-9-19-14/h5-6,10H,3-4,7-9H2,1-2H3.
What are the key properties of N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide?
N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide has a molecular weight of 273.33 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(8,9-dihydro-7H-furo[3,2-f]chromen-1-yl)ethyl]-N-methylacetamide is sourced from PubChem (CID 18782978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).