2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane

C10H15N5 — CID 102317289

IUPAC2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane
SMILESN1C2NC3NC4NC5NC1C1C2C3C4C51
InChIInChI=1S/C10H15N5/c11-6-1-2-4-5-3(1)8(12-6)14-10(5)15-9(4)13-7(2)11/h1-15H
InChIKeyNWQPRYVJBJJLJA-UHFFFAOYSA-N
MW205.27 g/mol
LogP-2.27
Rot. Bonds

About 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane

2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane (PubChem CID 102317289) has the molecular formula C10H15N5 and a molecular weight of 205.27 g/mol. Its IUPAC name is 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane.

Molecular Properties

Compound Name2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane
PubChem CID102317289
Molecular FormulaC10H15N5
Molecular Weight205.27 g/mol
Exact Mass205.13
IUPAC Name2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane
SMILESN1C2NC3NC4NC5NC1C1C2C3C4C51
InChIInChI=1S/C10H15N5/c11-6-1-2-4-5-3(1)8(12-6)14-10(5)15-9(4)13-7(2)11/h1-15H
InChIKeyNWQPRYVJBJJLJA-UHFFFAOYSA-N
XLogP-2.27
TPSA60.15 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.27
LogP ≤ 5-2.27
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane?
The IUPAC name of 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane (CID 102317289) is 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane.
What is the SMILES notation for 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane?
The canonical SMILES for 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane is N1C2NC3NC4NC5NC1C1C2C3C4C51.
What is the InChIKey of 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane?
The InChIKey is NWQPRYVJBJJLJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c11-6-1-2-4-5-3(1)8(12-6)14-10(5)15-9(4)13-7(2)11/h1-15H.
What are the key properties of 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane?
2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane has a molecular weight of 205.27 g/mol, XLogP of -2.27, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8,15-pentazahexacyclo[7.5.1.03,13.05,12.07,11.010,14]pentadecane is sourced from PubChem (CID 102317289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).