[1-(2-adamantyl)pyrrolidin-2-yl]methanol

C15H25NO — CID 2845433

IUPAC[1-(2-adamantyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C15H25NO/c17-9-14-2-1-3-16(14)15-12-5-10-4-11(7-12)8-13(15)6-10/h10-15,17H,1-9H2
InChIKeyLPCOSZDULGKLAI-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.27
Rot. Bonds2

About [1-(2-adamantyl)pyrrolidin-2-yl]methanol

[1-(2-adamantyl)pyrrolidin-2-yl]methanol (PubChem CID 2845433) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is [1-(2-adamantyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(2-adamantyl)pyrrolidin-2-yl]methanol
PubChem CID2845433
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name[1-(2-adamantyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C15H25NO/c17-9-14-2-1-3-16(14)15-12-5-10-4-11(7-12)8-13(15)6-10/h10-15,17H,1-9H2
InChIKeyLPCOSZDULGKLAI-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2-adamantyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(2-adamantyl)pyrrolidin-2-yl]methanol (CID 2845433) is [1-(2-adamantyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(2-adamantyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(2-adamantyl)pyrrolidin-2-yl]methanol is OCC1CCCN1C1C2CC3CC(C2)CC1C3.
What is the InChIKey of [1-(2-adamantyl)pyrrolidin-2-yl]methanol?
The InChIKey is LPCOSZDULGKLAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c17-9-14-2-1-3-16(14)15-12-5-10-4-11(7-12)8-13(15)6-10/h10-15,17H,1-9H2.
What are the key properties of [1-(2-adamantyl)pyrrolidin-2-yl]methanol?
[1-(2-adamantyl)pyrrolidin-2-yl]methanol has a molecular weight of 235.37 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-adamantyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 2845433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).