1,3,5,7-tetracyclopropyladamantane

C22H32 — CID 11300934

IUPAC1,3,5,7-tetracyclopropyladamantane
SMILESC1CC1C12CC3(C4CC4)CC(C4CC4)(C1)CC(C1CC1)(C2)C3
InChIInChI=1S/C22H32/c1-2-15(1)19-9-20(16-3-4-16)12-21(10-19,17-5-6-17)14-22(11-19,13-20)18-7-8-18/h15-18H,1-14H2
InChIKeyVXMNOBOEBJEUIK-UHFFFAOYSA-N
MW296.50 g/mol
LogP5.95
Rot. Bonds4

About 1,3,5,7-tetracyclopropyladamantane

1,3,5,7-tetracyclopropyladamantane (PubChem CID 11300934) has the molecular formula C22H32 and a molecular weight of 296.50 g/mol. Its IUPAC name is 1,3,5,7-tetracyclopropyladamantane.

Molecular Properties

Compound Name1,3,5,7-tetracyclopropyladamantane
PubChem CID11300934
Molecular FormulaC22H32
Molecular Weight296.50 g/mol
Exact Mass296.25
IUPAC Name1,3,5,7-tetracyclopropyladamantane
SMILESC1CC1C12CC3(C4CC4)CC(C4CC4)(C1)CC(C1CC1)(C2)C3
InChIInChI=1S/C22H32/c1-2-15(1)19-9-20(16-3-4-16)12-21(10-19,17-5-6-17)14-22(11-19,13-20)18-7-8-18/h15-18H,1-14H2
InChIKeyVXMNOBOEBJEUIK-UHFFFAOYSA-N
XLogP5.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.50
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,3,5,7-tetracyclopropyladamantane?
The IUPAC name of 1,3,5,7-tetracyclopropyladamantane (CID 11300934) is 1,3,5,7-tetracyclopropyladamantane.
What is the SMILES notation for 1,3,5,7-tetracyclopropyladamantane?
The canonical SMILES for 1,3,5,7-tetracyclopropyladamantane is C1CC1C12CC3(C4CC4)CC(C4CC4)(C1)CC(C1CC1)(C2)C3.
What is the InChIKey of 1,3,5,7-tetracyclopropyladamantane?
The InChIKey is VXMNOBOEBJEUIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32/c1-2-15(1)19-9-20(16-3-4-16)12-21(10-19,17-5-6-17)14-22(11-19,13-20)18-7-8-18/h15-18H,1-14H2.
What are the key properties of 1,3,5,7-tetracyclopropyladamantane?
1,3,5,7-tetracyclopropyladamantane has a molecular weight of 296.50 g/mol, XLogP of 5.95, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5,7-tetracyclopropyladamantane is sourced from PubChem (CID 11300934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).