3-pyrrolidin-1-yladamantan-1-ol;hydrochloride

C14H24ClNO — CID 2941938

IUPAC3-pyrrolidin-1-yladamantan-1-ol;hydrochloride
SMILESCl.OC12CC3CC(C1)CC(N1CCCC1)(C3)C2
InChIInChI=1S/C14H23NO.ClH/c16-14-8-11-5-12(9-14)7-13(6-11,10-14)15-3-1-2-4-15;/h11-12,16H,1-10H2;1H
InChIKeyWNVWRHZZRXKICM-UHFFFAOYSA-N
MW257.80 g/mol
LogP2.59
Rot. Bonds1

About 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride

3-pyrrolidin-1-yladamantan-1-ol;hydrochloride (PubChem CID 2941938) has the molecular formula C14H24ClNO and a molecular weight of 257.80 g/mol. Its IUPAC name is 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride.

Molecular Properties

Compound Name3-pyrrolidin-1-yladamantan-1-ol;hydrochloride
PubChem CID2941938
Molecular FormulaC14H24ClNO
Molecular Weight257.80 g/mol
Exact Mass257.15
IUPAC Name3-pyrrolidin-1-yladamantan-1-ol;hydrochloride
SMILESCl.OC12CC3CC(C1)CC(N1CCCC1)(C3)C2
InChIInChI=1S/C14H23NO.ClH/c16-14-8-11-5-12(9-14)7-13(6-11,10-14)15-3-1-2-4-15;/h11-12,16H,1-10H2;1H
InChIKeyWNVWRHZZRXKICM-UHFFFAOYSA-N
XLogP2.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.80
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride?
The IUPAC name of 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride (CID 2941938) is 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride.
What is the SMILES notation for 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride?
The canonical SMILES for 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride is Cl.OC12CC3CC(C1)CC(N1CCCC1)(C3)C2.
What is the InChIKey of 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride?
The InChIKey is WNVWRHZZRXKICM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO.ClH/c16-14-8-11-5-12(9-14)7-13(6-11,10-14)15-3-1-2-4-15;/h11-12,16H,1-10H2;1H.
What are the key properties of 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride?
3-pyrrolidin-1-yladamantan-1-ol;hydrochloride has a molecular weight of 257.80 g/mol, XLogP of 2.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-1-yladamantan-1-ol;hydrochloride is sourced from PubChem (CID 2941938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).