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

C16H24N2 — CID 126614746

IUPAC2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene
SMILESCC(C)=CC1=C(C)N2C=CN(C)C2C2(C)CC12C
InChIInChI=1S/C16H24N2/c1-11(2)9-13-12(3)18-8-7-17(6)14(18)16(5)10-15(13,16)4/h7-9,14H,10H2,1-6H3
InChIKeyDOIOEKXKYBTRGI-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.70
Rot. Bonds1

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

2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene (PubChem CID 126614746) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene.

Molecular Properties

Compound Name2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene
PubChem CID126614746
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene
SMILESCC(C)=CC1=C(C)N2C=CN(C)C2C2(C)CC12C
InChIInChI=1S/C16H24N2/c1-11(2)9-13-12(3)18-8-7-17(6)14(18)16(5)10-15(13,16)4/h7-9,14H,10H2,1-6H3
InChIKeyDOIOEKXKYBTRGI-UHFFFAOYSA-N
XLogP3.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.70
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-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
The IUPAC name of 2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene (CID 126614746) is 2,4,6,10-tetramethyl-5-(2-methylprop-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-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
The canonical SMILES for 2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene is CC(C)=CC1=C(C)N2C=CN(C)C2C2(C)CC12C.
What is the InChIKey of 2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
The InChIKey is DOIOEKXKYBTRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-11(2)9-13-12(3)18-8-7-17(6)14(18)16(5)10-15(13,16)4/h7-9,14H,10H2,1-6H3.
What are the key properties of 2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene?
2,4,6,10-tetramethyl-5-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene has a molecular weight of 244.38 g/mol, XLogP of 3.70, 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-(2-methylprop-1-enyl)-7,10-diazatricyclo[5.3.0.02,4]deca-5,8-diene is sourced from PubChem (CID 126614746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).