(1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol

C10H19NO — CID 57321720

IUPAC(1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESCC1C(O)C(C)[C@@H]2CC[C@H]1N2C
InChIInChI=1S/C10H19NO/c1-6-8-4-5-9(11(8)3)7(2)10(6)12/h6-10,12H,4-5H2,1-3H3/t6?,7?,8-,9+,10?
InChIKeySLUSNFGEGRDOGA-FTKOINSTSA-N
MW169.27 g/mol
LogP1.10
Rot. Bonds

About (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol

(1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 57321720) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name(1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID57321720
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESCC1C(O)C(C)[C@@H]2CC[C@H]1N2C
InChIInChI=1S/C10H19NO/c1-6-8-4-5-9(11(8)3)7(2)10(6)12/h6-10,12H,4-5H2,1-3H3/t6?,7?,8-,9+,10?
InChIKeySLUSNFGEGRDOGA-FTKOINSTSA-N
XLogP1.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol (CID 57321720) is (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol is CC1C(O)C(C)[C@@H]2CC[C@H]1N2C.
What is the InChIKey of (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is SLUSNFGEGRDOGA-FTKOINSTSA-N. The full InChI is InChI=1S/C10H19NO/c1-6-8-4-5-9(11(8)3)7(2)10(6)12/h6-10,12H,4-5H2,1-3H3/t6?,7?,8-,9+,10?.
What are the key properties of (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol?
(1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 169.27 g/mol, XLogP of 1.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5S)-2,4,8-trimethyl-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 57321720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).