1-(1-adamantyl)pyrrolidine

C14H23N — CID 3010125

IUPAC1-(1-adamantyl)pyrrolidine
SMILESC1CCN(C23CC4CC(CC(C4)C2)C3)C1
InChIInChI=1S/C14H23N/c1-2-4-15(3-1)14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,1-10H2
InChIKeyCUJGRKBCPJELRW-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.05
Rot. Bonds1

About 1-(1-adamantyl)pyrrolidine

1-(1-adamantyl)pyrrolidine (PubChem CID 3010125) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 1-(1-adamantyl)pyrrolidine.

Molecular Properties

Compound Name1-(1-adamantyl)pyrrolidine
PubChem CID3010125
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name1-(1-adamantyl)pyrrolidine
SMILESC1CCN(C23CC4CC(CC(C4)C2)C3)C1
InChIInChI=1S/C14H23N/c1-2-4-15(3-1)14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,1-10H2
InChIKeyCUJGRKBCPJELRW-UHFFFAOYSA-N
XLogP3.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantyl)pyrrolidine?
The IUPAC name of 1-(1-adamantyl)pyrrolidine (CID 3010125) is 1-(1-adamantyl)pyrrolidine.
What is the SMILES notation for 1-(1-adamantyl)pyrrolidine?
The canonical SMILES for 1-(1-adamantyl)pyrrolidine is C1CCN(C23CC4CC(CC(C4)C2)C3)C1.
What is the InChIKey of 1-(1-adamantyl)pyrrolidine?
The InChIKey is CUJGRKBCPJELRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-4-15(3-1)14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,1-10H2.
What are the key properties of 1-(1-adamantyl)pyrrolidine?
1-(1-adamantyl)pyrrolidine has a molecular weight of 205.34 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantyl)pyrrolidine is sourced from PubChem (CID 3010125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).