7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene

C14H17N — CID 70374207

IUPAC7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene
SMILESCC1C=C2C=NC=CC3=C2C(CCC3)C1
InChIInChI=1S/C14H17N/c1-10-7-12-4-2-3-11-5-6-15-9-13(8-10)14(11)12/h5-6,8-10,12H,2-4,7H2,1H3
InChIKeyMMUFWCMUZVATGA-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.65
Rot. Bonds

About 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene

7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene (PubChem CID 70374207) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene.

Molecular Properties

Compound Name7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene
PubChem CID70374207
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene
SMILESCC1C=C2C=NC=CC3=C2C(CCC3)C1
InChIInChI=1S/C14H17N/c1-10-7-12-4-2-3-11-5-6-15-9-13(8-10)14(11)12/h5-6,8-10,12H,2-4,7H2,1H3
InChIKeyMMUFWCMUZVATGA-UHFFFAOYSA-N
XLogP3.65
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene?
The IUPAC name of 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene (CID 70374207) is 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene.
What is the SMILES notation for 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene?
The canonical SMILES for 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene is CC1C=C2C=NC=CC3=C2C(CCC3)C1.
What is the InChIKey of 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene?
The InChIKey is MMUFWCMUZVATGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N/c1-10-7-12-4-2-3-11-5-6-15-9-13(8-10)14(11)12/h5-6,8-10,12H,2-4,7H2,1H3.
What are the key properties of 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene?
7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene has a molecular weight of 199.30 g/mol, XLogP of 3.65, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-11-azatricyclo[7.4.1.05,14]tetradeca-1(14),8,10,12-tetraene is sourced from PubChem (CID 70374207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).