(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene

C14H25N3 — CID 134313188

IUPAC(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene
SMILESCC1C2CCCC3=C(CCC[C@H]12)N(C)NN3C
InChIInChI=1S/C14H25N3/c1-10-11-6-4-8-13-14(9-5-7-12(10)11)17(3)15-16(13)2/h10-12,15H,4-9H2,1-3H3/t10?,11-,12?/m1/s1
InChIKeyDIZFFAOPOGCWJR-MOENNCHZSA-N
MW235.37 g/mol
LogP2.73
Rot. Bonds

About (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene

(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene (PubChem CID 134313188) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene.

Molecular Properties

Compound Name(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene
PubChem CID134313188
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene
SMILESCC1C2CCCC3=C(CCC[C@H]12)N(C)NN3C
InChIInChI=1S/C14H25N3/c1-10-11-6-4-8-13-14(9-5-7-12(10)11)17(3)15-16(13)2/h10-12,15H,4-9H2,1-3H3/t10?,11-,12?/m1/s1
InChIKeyDIZFFAOPOGCWJR-MOENNCHZSA-N
XLogP2.73
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene?
The IUPAC name of (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene (CID 134313188) is (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene.
What is the SMILES notation for (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene?
The canonical SMILES for (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene is CC1C2CCCC3=C(CCC[C@H]12)N(C)NN3C.
What is the InChIKey of (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene?
The InChIKey is DIZFFAOPOGCWJR-MOENNCHZSA-N. The full InChI is InChI=1S/C14H25N3/c1-10-11-6-4-8-13-14(9-5-7-12(10)11)17(3)15-16(13)2/h10-12,15H,4-9H2,1-3H3/t10?,11-,12?/m1/s1.
What are the key properties of (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene?
(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene has a molecular weight of 235.37 g/mol, XLogP of 2.73, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene is sourced from PubChem (CID 134313188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).