2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine

C19H23NO3 — CID 117498749

IUPAC2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine
SMILESCOc1c2cc(C)oc2c(CC2CCCCN2)c2cc(C)oc12
InChIInChI=1S/C19H23NO3/c1-11-8-14-15(10-13-6-4-5-7-20-13)17-16(9-12(2)22-17)18(21-3)19(14)23-11/h8-9,13,20H,4-7,10H2,1-3H3
InChIKeyYMCKFNGOEZJRGK-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.49
Rot. Bonds3

About 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine

2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine (PubChem CID 117498749) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine.

Molecular Properties

Compound Name2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine
PubChem CID117498749
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine
SMILESCOc1c2cc(C)oc2c(CC2CCCCN2)c2cc(C)oc12
InChIInChI=1S/C19H23NO3/c1-11-8-14-15(10-13-6-4-5-7-20-13)17-16(9-12(2)22-17)18(21-3)19(14)23-11/h8-9,13,20H,4-7,10H2,1-3H3
InChIKeyYMCKFNGOEZJRGK-UHFFFAOYSA-N
XLogP4.49
TPSA47.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)methyl]pyrrolidine
CID 117426679
2-[(2,3,6-trimethoxyphenyl)methyl]piperidine
CID 117417665
2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine
CID 117377139
2-[(6-chloro-2-methoxy-3-methylphenyl)methyl]piperidine
CID 117387667
3-fluoro-2-methoxy-5-methyl-6-(piperidin-2-ylmethyl)phenol
CID 117386337
2-[(3-chloro-5-fluoro-2-methoxy-6-methylphenyl)methyl]piperidine
CID 117432392
2-[(2-chloro-3,6-dimethoxy-4-methylphenyl)methyl]pyrrolidine
CID 117427732
2-[(6-ethyl-2,3-dimethoxyphenyl)methyl]piperidine
CID 117413480
2-[(3-chloro-2-methoxy-4,6-dimethylphenyl)methyl]pyrrolidine
CID 117387647
2-[(2-methyl-1-benzofuran-5-yl)methyl]piperidine
CID 117331068
2-methoxy-3,4-dimethyl-5-(piperidin-2-ylmethyl)phenol
CID 117377144
2-[(4-fluoro-2,3-dimethoxy-6-methylphenyl)methyl]pyrrolidine
CID 117386317

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine?
The IUPAC name of 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine (CID 117498749) is 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine.
What is the SMILES notation for 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine?
The canonical SMILES for 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine is COc1c2cc(C)oc2c(CC2CCCCN2)c2cc(C)oc12.
What is the InChIKey of 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine?
The InChIKey is YMCKFNGOEZJRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-11-8-14-15(10-13-6-4-5-7-20-13)17-16(9-12(2)22-17)18(21-3)19(14)23-11/h8-9,13,20H,4-7,10H2,1-3H3.
What are the key properties of 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine?
2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine has a molecular weight of 313.40 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-2,6-dimethylfuro[2,3-f][1]benzofuran-8-yl)methyl]piperidine is sourced from PubChem (CID 117498749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).