1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane

C15H34N4 — CID 15198794

IUPAC1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane
SMILESCN1CCCN(C)CCCN(C)CCN(C)CCC1
InChIInChI=1S/C15H34N4/c1-16-8-5-9-17(2)11-7-13-19(4)15-14-18(3)12-6-10-16/h5-15H2,1-4H3
InChIKeyOABQWLAKKVQVQP-UHFFFAOYSA-N
MW270.46 g/mol
LogP0.90
Rot. Bonds

About 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane

1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane (PubChem CID 15198794) has the molecular formula C15H34N4 and a molecular weight of 270.46 g/mol. Its IUPAC name is 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane.

Molecular Properties

Compound Name1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane
PubChem CID15198794
Molecular FormulaC15H34N4
Molecular Weight270.46 g/mol
Exact Mass270.28
IUPAC Name1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane
SMILESCN1CCCN(C)CCCN(C)CCN(C)CCC1
InChIInChI=1S/C15H34N4/c1-16-8-5-9-17(2)11-7-13-19(4)15-14-18(3)12-6-10-16/h5-15H2,1-4H3
InChIKeyOABQWLAKKVQVQP-UHFFFAOYSA-N
XLogP0.90
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane?
The IUPAC name of 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane (CID 15198794) is 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane.
What is the SMILES notation for 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane?
The canonical SMILES for 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane is CN1CCCN(C)CCCN(C)CCN(C)CCC1.
What is the InChIKey of 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane?
The InChIKey is OABQWLAKKVQVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N4/c1-16-8-5-9-17(2)11-7-13-19(4)15-14-18(3)12-6-10-16/h5-15H2,1-4H3.
What are the key properties of 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane?
1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane has a molecular weight of 270.46 g/mol, XLogP of 0.90, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane is sourced from PubChem (CID 15198794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).