2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine

C14H17NO — CID 81048813

IUPAC2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine
SMILESCNCCc1coc2cc3c(cc12)CCC3
InChIInChI=1S/C14H17NO/c1-15-6-5-12-9-16-14-8-11-4-2-3-10(11)7-13(12)14/h7-9,15H,2-6H2,1H3
InChIKeyDNMCSOLEWCROJM-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.68
Rot. Bonds3

About 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine

2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine (PubChem CID 81048813) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine
PubChem CID81048813
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine
SMILESCNCCc1coc2cc3c(cc12)CCC3
InChIInChI=1S/C14H17NO/c1-15-6-5-12-9-16-14-8-11-4-2-3-10(11)7-13(12)14/h7-9,15H,2-6H2,1H3
InChIKeyDNMCSOLEWCROJM-UHFFFAOYSA-N
XLogP2.68
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine?
The IUPAC name of 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine (CID 81048813) is 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine.
What is the SMILES notation for 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine?
The canonical SMILES for 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine is CNCCc1coc2cc3c(cc12)CCC3.
What is the InChIKey of 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine?
The InChIKey is DNMCSOLEWCROJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-15-6-5-12-9-16-14-8-11-4-2-3-10(11)7-13(12)14/h7-9,15H,2-6H2,1H3.
What are the key properties of 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine?
2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine has a molecular weight of 215.30 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)-N-methylethanamine is sourced from PubChem (CID 81048813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).