2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene

C15H22N2 — CID 129035069

IUPAC2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene
SMILESC/C=C\C1=C(C)N2C=CN(C)C2C2(C)CC12C
InChIInChI=1S/C15H22N2/c1-6-7-12-11(2)17-9-8-16(5)13(17)15(4)10-14(12,15)3/h6-9,13H,10H2,1-5H3/b7-6-
InChIKeyFYDIBYQTKUCCCN-SREVYHEPSA-N
MW230.35 g/mol
LogP3.31
Rot. Bonds1

About 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene

2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene (PubChem CID 129035069) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene.

Molecular Properties

Compound Name2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene
PubChem CID129035069
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene
SMILESC/C=C\C1=C(C)N2C=CN(C)C2C2(C)CC12C
InChIInChI=1S/C15H22N2/c1-6-7-12-11(2)17-9-8-16(5)13(17)15(4)10-14(12,15)3/h6-9,13H,10H2,1-5H3/b7-6-
InChIKeyFYDIBYQTKUCCCN-SREVYHEPSA-N
XLogP3.31
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
The IUPAC name of 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene (CID 129035069) is 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene.
What is the SMILES notation for 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
The canonical SMILES for 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene is C/C=C\C1=C(C)N2C=CN(C)C2C2(C)CC12C.
What is the InChIKey of 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
The InChIKey is FYDIBYQTKUCCCN-SREVYHEPSA-N. The full InChI is InChI=1S/C15H22N2/c1-6-7-12-11(2)17-9-8-16(5)13(17)15(4)10-14(12,15)3/h6-9,13H,10H2,1-5H3/b7-6-.
What are the key properties of 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene has a molecular weight of 230.35 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,10-tetramethyl-5-[(Z)-prop-1-enyl]-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene is sourced from PubChem (CID 129035069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).