(2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane

C14H26N4 — CID 15691263

IUPAC(2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane
SMILESC[C@@H]1C[C@H](C)N2CN3C4C2N1CN4[C@H](C)C[C@@H]3C
InChIInChI=1S/C14H26N4/c1-9-5-10(2)17-8-18-12(4)6-11(3)16-7-15(9)13(17)14(16)18/h9-14H,5-8H2,1-4H3/t9-,10+,11-,12+,13?,14?
InChIKeyBYFMUBAGHIFGCH-QHMRNEKISA-N
MW250.39 g/mol
LogP1.15
Rot. Bonds

About (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane

(2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane (PubChem CID 15691263) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane.

Molecular Properties

Compound Name(2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane
PubChem CID15691263
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name(2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane
SMILESC[C@@H]1C[C@H](C)N2CN3C4C2N1CN4[C@H](C)C[C@@H]3C
InChIInChI=1S/C14H26N4/c1-9-5-10(2)17-8-18-12(4)6-11(3)16-7-15(9)13(17)14(16)18/h9-14H,5-8H2,1-4H3/t9-,10+,11-,12+,13?,14?
InChIKeyBYFMUBAGHIFGCH-QHMRNEKISA-N
XLogP1.15
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane?
The IUPAC name of (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane (CID 15691263) is (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane.
What is the SMILES notation for (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane?
The canonical SMILES for (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane is C[C@@H]1C[C@H](C)N2CN3C4C2N1CN4[C@H](C)C[C@@H]3C.
What is the InChIKey of (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane?
The InChIKey is BYFMUBAGHIFGCH-QHMRNEKISA-N. The full InChI is InChI=1S/C14H26N4/c1-9-5-10(2)17-8-18-12(4)6-11(3)16-7-15(9)13(17)14(16)18/h9-14H,5-8H2,1-4H3/t9-,10+,11-,12+,13?,14?.
What are the key properties of (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane?
(2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane has a molecular weight of 250.39 g/mol, XLogP of 1.15, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S,8S,10R)-2,4,8,10-tetramethyl-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane is sourced from PubChem (CID 15691263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).