1,4,8,11-tetrazoniacyclotetradecane

C10H28N4+4 — CID 7157052

IUPAC1,4,8,11-tetrazoniacyclotetradecane
SMILESC1C[NH2+]CC[NH2+]CCC[NH2+]CC[NH2+]C1
InChIInChI=1S/C10H24N4/c1-3-11-7-9-13-5-2-6-14-10-8-12-4-1/h11-14H,1-10H2/p+4
InChIKeyMDAXKAUIABOHTD-UHFFFAOYSA-R
MW204.36 g/mol
LogP-4.97
Rot. Bonds

About 1,4,8,11-tetrazoniacyclotetradecane

1,4,8,11-tetrazoniacyclotetradecane (PubChem CID 7157052) has the molecular formula C10H28N4+4 and a molecular weight of 204.36 g/mol. Its IUPAC name is 1,4,8,11-tetrazoniacyclotetradecane.

Molecular Properties

Compound Name1,4,8,11-tetrazoniacyclotetradecane
PubChem CID7157052
Molecular FormulaC10H28N4+4
Molecular Weight204.36 g/mol
Exact Mass204.23
IUPAC Name1,4,8,11-tetrazoniacyclotetradecane
SMILESC1C[NH2+]CC[NH2+]CCC[NH2+]CC[NH2+]C1
InChIInChI=1S/C10H24N4/c1-3-11-7-9-13-5-2-6-14-10-8-12-4-1/h11-14H,1-10H2/p+4
InChIKeyMDAXKAUIABOHTD-UHFFFAOYSA-R
XLogP-4.97
TPSA66.44 Ų
H-Bond Donors4
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 5-4.97
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,4,8,11-tetrazoniacyclotetradecane?
The IUPAC name of 1,4,8,11-tetrazoniacyclotetradecane (CID 7157052) is 1,4,8,11-tetrazoniacyclotetradecane.
What is the SMILES notation for 1,4,8,11-tetrazoniacyclotetradecane?
The canonical SMILES for 1,4,8,11-tetrazoniacyclotetradecane is C1C[NH2+]CC[NH2+]CCC[NH2+]CC[NH2+]C1.
What is the InChIKey of 1,4,8,11-tetrazoniacyclotetradecane?
The InChIKey is MDAXKAUIABOHTD-UHFFFAOYSA-R. The full InChI is InChI=1S/C10H24N4/c1-3-11-7-9-13-5-2-6-14-10-8-12-4-1/h11-14H,1-10H2/p+4.
What are the key properties of 1,4,8,11-tetrazoniacyclotetradecane?
1,4,8,11-tetrazoniacyclotetradecane has a molecular weight of 204.36 g/mol, XLogP of -4.97, 0 rotatable bonds, 4 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,8,11-tetrazoniacyclotetradecane is sourced from PubChem (CID 7157052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).