6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene

C15H18N2O2 — CID 18992507

IUPAC6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene
SMILESCOc1cc2c(cc1OC)N=C1C3CCC(C3)N1C2
InChIInChI=1S/C15H18N2O2/c1-18-13-6-10-8-17-11-4-3-9(5-11)15(17)16-12(10)7-14(13)19-2/h6-7,9,11H,3-5,8H2,1-2H3
InChIKeyJZGSCIPODPRQKY-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.73
Rot. Bonds2

About 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene

6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene (PubChem CID 18992507) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene.

Molecular Properties

Compound Name6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene
PubChem CID18992507
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene
SMILESCOc1cc2c(cc1OC)N=C1C3CCC(C3)N1C2
InChIInChI=1S/C15H18N2O2/c1-18-13-6-10-8-17-11-4-3-9(5-11)15(17)16-12(10)7-14(13)19-2/h6-7,9,11H,3-5,8H2,1-2H3
InChIKeyJZGSCIPODPRQKY-UHFFFAOYSA-N
XLogP2.73
TPSA34.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene?
The IUPAC name of 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene (CID 18992507) is 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene.
What is the SMILES notation for 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene?
The canonical SMILES for 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene is COc1cc2c(cc1OC)N=C1C3CCC(C3)N1C2.
What is the InChIKey of 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene?
The InChIKey is JZGSCIPODPRQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-18-13-6-10-8-17-11-4-3-9(5-11)15(17)16-12(10)7-14(13)19-2/h6-7,9,11H,3-5,8H2,1-2H3.
What are the key properties of 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene?
6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene has a molecular weight of 258.32 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-2,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-4,6,8,10-tetraene is sourced from PubChem (CID 18992507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).