N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine

C17H23NO — CID 19041541

IUPACN,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine
SMILESCCCN(CCC)C1Cc2cc3ccoc3cc2C1
InChIInChI=1S/C17H23NO/c1-3-6-18(7-4-2)16-10-14-9-13-5-8-19-17(13)12-15(14)11-16/h5,8-9,12,16H,3-4,6-7,10-11H2,1-2H3
InChIKeyZACCFGQTAXOCFF-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.02
Rot. Bonds5

About N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine

N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine (PubChem CID 19041541) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine.

Molecular Properties

Compound NameN,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine
PubChem CID19041541
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC NameN,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine
SMILESCCCN(CCC)C1Cc2cc3ccoc3cc2C1
InChIInChI=1S/C17H23NO/c1-3-6-18(7-4-2)16-10-14-9-13-5-8-19-17(13)12-15(14)11-16/h5,8-9,12,16H,3-4,6-7,10-11H2,1-2H3
InChIKeyZACCFGQTAXOCFF-UHFFFAOYSA-N
XLogP4.02
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine?
The IUPAC name of N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine (CID 19041541) is N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine.
What is the SMILES notation for N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine?
The canonical SMILES for N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine is CCCN(CCC)C1Cc2cc3ccoc3cc2C1.
What is the InChIKey of N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine?
The InChIKey is ZACCFGQTAXOCFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-3-6-18(7-4-2)16-10-14-9-13-5-8-19-17(13)12-15(14)11-16/h5,8-9,12,16H,3-4,6-7,10-11H2,1-2H3.
What are the key properties of N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine?
N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine has a molecular weight of 257.38 g/mol, XLogP of 4.02, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-6,7-dihydro-5H-cyclopenta[f][1]benzofuran-6-amine is sourced from PubChem (CID 19041541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).