(1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride

C10H20ClN — CID 22875698

IUPAC(1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride
SMILESCC1(C)C2CC[C@@]1(C)CNC2.Cl
InChIInChI=1S/C10H19N.ClH/c1-9(2)8-4-5-10(9,3)7-11-6-8;/h8,11H,4-7H2,1-3H3;1H/t8?,10-;/m0./s1
InChIKeyMNWDWUQDCHTKOC-LQRGNCEWSA-N
MW189.73 g/mol
LogP2.45
Rot. Bonds

About (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride

(1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride (PubChem CID 22875698) has the molecular formula C10H20ClN and a molecular weight of 189.73 g/mol. Its IUPAC name is (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride.

Molecular Properties

Compound Name(1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride
PubChem CID22875698
Molecular FormulaC10H20ClN
Molecular Weight189.73 g/mol
Exact Mass189.13
IUPAC Name(1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride
SMILESCC1(C)C2CC[C@@]1(C)CNC2.Cl
InChIInChI=1S/C10H19N.ClH/c1-9(2)8-4-5-10(9,3)7-11-6-8;/h8,11H,4-7H2,1-3H3;1H/t8?,10-;/m0./s1
InChIKeyMNWDWUQDCHTKOC-LQRGNCEWSA-N
XLogP2.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.73
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride?
The IUPAC name of (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride (CID 22875698) is (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride.
What is the SMILES notation for (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride?
The canonical SMILES for (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride is CC1(C)C2CC[C@@]1(C)CNC2.Cl.
What is the InChIKey of (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride?
The InChIKey is MNWDWUQDCHTKOC-LQRGNCEWSA-N. The full InChI is InChI=1S/C10H19N.ClH/c1-9(2)8-4-5-10(9,3)7-11-6-8;/h8,11H,4-7H2,1-3H3;1H/t8?,10-;/m0./s1.
What are the key properties of (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride?
(1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride has a molecular weight of 189.73 g/mol, XLogP of 2.45, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane;hydrochloride is sourced from PubChem (CID 22875698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).