5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene

C14H24N4 — CID 15304008

IUPAC5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene
SMILESC/C1=N\CC/N=C(\C)C/C(C)=N/CC/N=C(\C)C1
InChIInChI=1S/C14H24N4/c1-11-9-12(2)16-7-8-18-14(4)10-13(3)17-6-5-15-11/h5-10H2,1-4H3/b15-11+,16-12+,17-13+,18-14+
InChIKeyVQXSZORDGUCYIM-UKGXNTCXSA-N
MW248.37 g/mol
LogP2.62
Rot. Bonds

About 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene

5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene (PubChem CID 15304008) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene.

Molecular Properties

Compound Name5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene
PubChem CID15304008
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene
SMILESC/C1=N\CC/N=C(\C)C/C(C)=N/CC/N=C(\C)C1
InChIInChI=1S/C14H24N4/c1-11-9-12(2)16-7-8-18-14(4)10-13(3)17-6-5-15-11/h5-10H2,1-4H3/b15-11+,16-12+,17-13+,18-14+
InChIKeyVQXSZORDGUCYIM-UKGXNTCXSA-N
XLogP2.62
TPSA49.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene?
The IUPAC name of 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene (CID 15304008) is 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene.
What is the SMILES notation for 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene?
The canonical SMILES for 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene is C/C1=N\CC/N=C(\C)C/C(C)=N/CC/N=C(\C)C1.
What is the InChIKey of 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene?
The InChIKey is VQXSZORDGUCYIM-UKGXNTCXSA-N. The full InChI is InChI=1S/C14H24N4/c1-11-9-12(2)16-7-8-18-14(4)10-13(3)17-6-5-15-11/h5-10H2,1-4H3/b15-11+,16-12+,17-13+,18-14+.
What are the key properties of 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene?
5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene has a molecular weight of 248.37 g/mol, XLogP of 2.62, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7,12,14-tetramethyl-1,4,8,11-tetrazacyclotetradeca-4,7,11,14-tetraene is sourced from PubChem (CID 15304008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).