[1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine

C19H23NO2 — CID 117479065

IUPAC[1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine
SMILESCc1cc2c(C3(CN)CCCCC3)c3oc(C)cc3cc2o1
InChIInChI=1S/C19H23NO2/c1-12-8-14-10-16-15(9-13(2)21-16)17(18(14)22-12)19(11-20)6-4-3-5-7-19/h8-10H,3-7,11,20H2,1-2H3
InChIKeyZMQAVHCYMANDOO-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.96
Rot. Bonds2

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

[1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine (PubChem CID 117479065) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine
PubChem CID117479065
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name[1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine
SMILESCc1cc2c(C3(CN)CCCCC3)c3oc(C)cc3cc2o1
InChIInChI=1S/C19H23NO2/c1-12-8-14-10-16-15(9-13(2)21-16)17(18(14)22-12)19(11-20)6-4-3-5-7-19/h8-10H,3-7,11,20H2,1-2H3
InChIKeyZMQAVHCYMANDOO-UHFFFAOYSA-N
XLogP4.96
TPSA52.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine?
The IUPAC name of [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine (CID 117479065) is [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine?
The canonical SMILES for [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine is Cc1cc2c(C3(CN)CCCCC3)c3oc(C)cc3cc2o1.
What is the InChIKey of [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine?
The InChIKey is ZMQAVHCYMANDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-12-8-14-10-16-15(9-13(2)21-16)17(18(14)22-12)19(11-20)6-4-3-5-7-19/h8-10H,3-7,11,20H2,1-2H3.
What are the key properties of [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine?
[1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine has a molecular weight of 297.40 g/mol, XLogP of 4.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylfuro[2,3-f][1]benzofuran-4-yl)cyclohexyl]methanamine is sourced from PubChem (CID 117479065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).