3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine

C11H13NO2 — CID 55272686

IUPAC3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine
SMILESNC1COc2cc3c(cc21)CCCO3
InChIInChI=1S/C11H13NO2/c12-9-6-14-11-5-10-7(4-8(9)11)2-1-3-13-10/h4-5,9H,1-3,6,12H2
InChIKeyZPZDQUTZNHZEJL-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.40
Rot. Bonds

About 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine

3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine (PubChem CID 55272686) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine.

Molecular Properties

Compound Name3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine
PubChem CID55272686
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine
SMILESNC1COc2cc3c(cc21)CCCO3
InChIInChI=1S/C11H13NO2/c12-9-6-14-11-5-10-7(4-8(9)11)2-1-3-13-10/h4-5,9H,1-3,6,12H2
InChIKeyZPZDQUTZNHZEJL-UHFFFAOYSA-N
XLogP1.40
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine?
The IUPAC name of 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine (CID 55272686) is 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine.
What is the SMILES notation for 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine?
The canonical SMILES for 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine is NC1COc2cc3c(cc21)CCCO3.
What is the InChIKey of 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine?
The InChIKey is ZPZDQUTZNHZEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c12-9-6-14-11-5-10-7(4-8(9)11)2-1-3-13-10/h4-5,9H,1-3,6,12H2.
What are the key properties of 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine?
3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine has a molecular weight of 191.23 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,6,7-tetrahydro-2H-furo[3,2-g]chromen-3-amine is sourced from PubChem (CID 55272686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).