2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine

C17H19NO2 — CID 117426679

IUPAC2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine
SMILESCc1cc2c(CC3CCCN3)c3oc(C)cc3cc2o1
InChIInChI=1S/C17H19NO2/c1-10-6-12-8-16-14(7-11(2)19-16)15(17(12)20-10)9-13-4-3-5-18-13/h6-8,13,18H,3-5,9H2,1-2H3
InChIKeyBEAANVVZNHIOBU-UHFFFAOYSA-N
MW269.34 g/mol
LogP4.09
Rot. Bonds2

About 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine

2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine (PubChem CID 117426679) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine.

Molecular Properties

Compound Name2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine
PubChem CID117426679
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine
SMILESCc1cc2c(CC3CCCN3)c3oc(C)cc3cc2o1
InChIInChI=1S/C17H19NO2/c1-10-6-12-8-16-14(7-11(2)19-16)15(17(12)20-10)9-13-4-3-5-18-13/h6-8,13,18H,3-5,9H2,1-2H3
InChIKeyBEAANVVZNHIOBU-UHFFFAOYSA-N
XLogP4.09
TPSA38.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine
CID 117498749
2-[(2-methyl-1-benzofuran-5-yl)methyl]piperidine
CID 117331068
2-[(8-methylfuro[2,3-f][1]benzofuran-4-yl)methyl]piperidine
CID 115010239
5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-benzoxazole
CID 61372317
2,3,5-trimethyl-4-(pyrrolidin-2-ylmethyl)phenol
CID 117118250
2-[(2-bromo-4,6-dimethylphenyl)methyl]pyrrolidine
CID 84808310
2-[(4-fluoro-2,3-dimethoxy-6-methylphenyl)methyl]pyrrolidine
CID 117386317
2-[(3-chloro-2-methoxy-4,6-dimethylphenyl)methyl]pyrrolidine
CID 117387647
2-[(2,3-dimethoxy-5,6-dimethylphenyl)methyl]pyrrolidine
CID 117377110
2-[(3,4,5-trimethylphenyl)methyl]pyrrolidine
CID 117292011
2-[(2-bromo-3,6-dimethylphenyl)methyl]pyrrolidine
CID 84808311
2-[(3-bromo-5-fluoro-2,6-dimethylphenyl)methyl]pyrrolidine
CID 84813703

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine?
The IUPAC name of 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine (CID 117426679) is 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine.
What is the SMILES notation for 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine?
The canonical SMILES for 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine is Cc1cc2c(CC3CCCN3)c3oc(C)cc3cc2o1.
What is the InChIKey of 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine?
The InChIKey is BEAANVVZNHIOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-10-6-12-8-16-14(7-11(2)19-16)15(17(12)20-10)9-13-4-3-5-18-13/h6-8,13,18H,3-5,9H2,1-2H3.
What are the key properties of 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine?
2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine has a molecular weight of 269.34 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine is sourced from PubChem (CID 117426679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).