3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane

C15H32N2O — CID 15420794

IUPAC3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane
SMILESCC1CCN(C)CCCN(C)CCC(C)COC1
InChIInChI=1S/C15H32N2O/c1-14-6-10-16(3)8-5-9-17(4)11-7-15(2)13-18-12-14/h14-15H,5-13H2,1-4H3
InChIKeyBHIAGQQMLMLMBF-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.32
Rot. Bonds

About 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane

3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane (PubChem CID 15420794) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane.

Molecular Properties

Compound Name3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane
PubChem CID15420794
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane
SMILESCC1CCN(C)CCCN(C)CCC(C)COC1
InChIInChI=1S/C15H32N2O/c1-14-6-10-16(3)8-5-9-17(4)11-7-15(2)13-18-12-14/h14-15H,5-13H2,1-4H3
InChIKeyBHIAGQQMLMLMBF-UHFFFAOYSA-N
XLogP2.32
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane?
The IUPAC name of 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane (CID 15420794) is 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane.
What is the SMILES notation for 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane?
The canonical SMILES for 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane is CC1CCN(C)CCCN(C)CCC(C)COC1.
What is the InChIKey of 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane?
The InChIKey is BHIAGQQMLMLMBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-14-6-10-16(3)8-5-9-17(4)11-7-15(2)13-18-12-14/h14-15H,5-13H2,1-4H3.
What are the key properties of 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane?
3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane has a molecular weight of 256.43 g/mol, XLogP of 2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,10,13-tetramethyl-1-oxa-6,10-diazacyclotetradecane is sourced from PubChem (CID 15420794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).