1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline

C19H24N2O2 — CID 50902028

IUPAC1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline
SMILESCOc1cc2c(cc1OC)-c1c(C3CCCCC3)ncn1CC2
InChIInChI=1S/C19H24N2O2/c1-22-16-10-14-8-9-21-12-20-18(13-6-4-3-5-7-13)19(21)15(14)11-17(16)23-2/h10-13H,3-9H2,1-2H3
InChIKeyKUWKIEDCDSZEHG-UHFFFAOYSA-N
MW312.41 g/mol
LogP4.17
Rot. Bonds3

About 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline

1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline (PubChem CID 50902028) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline.

Molecular Properties

Compound Name1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline
PubChem CID50902028
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline
SMILESCOc1cc2c(cc1OC)-c1c(C3CCCCC3)ncn1CC2
InChIInChI=1S/C19H24N2O2/c1-22-16-10-14-8-9-21-12-20-18(13-6-4-3-5-7-13)19(21)15(14)11-17(16)23-2/h10-13H,3-9H2,1-2H3
InChIKeyKUWKIEDCDSZEHG-UHFFFAOYSA-N
XLogP4.17
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline?
The IUPAC name of 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline (CID 50902028) is 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline.
What is the SMILES notation for 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline?
The canonical SMILES for 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline is COc1cc2c(cc1OC)-c1c(C3CCCCC3)ncn1CC2.
What is the InChIKey of 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline?
The InChIKey is KUWKIEDCDSZEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-22-16-10-14-8-9-21-12-20-18(13-6-4-3-5-7-13)19(21)15(14)11-17(16)23-2/h10-13H,3-9H2,1-2H3.
What are the key properties of 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline?
1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline has a molecular weight of 312.41 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinoline is sourced from PubChem (CID 50902028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).