[(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol

C13H23NO — CID 59551270

IUPAC[(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol
SMILESCN1C[C@]2(C[C@H]1CO)C(C)(C)C21CCC1
InChIInChI=1S/C13H23NO/c1-11(2)12(5-4-6-12)13(11)7-10(8-15)14(3)9-13/h10,15H,4-9H2,1-3H3/t10-,13+/m0/s1
InChIKeySHNBJOFBRKFCLJ-GXFFZTMASA-N
MW209.33 g/mol
LogP1.88
Rot. Bonds1

About [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol

[(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol (PubChem CID 59551270) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol.

Molecular Properties

Compound Name[(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol
PubChem CID59551270
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name[(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol
SMILESCN1C[C@]2(C[C@H]1CO)C(C)(C)C21CCC1
InChIInChI=1S/C13H23NO/c1-11(2)12(5-4-6-12)13(11)7-10(8-15)14(3)9-13/h10,15H,4-9H2,1-3H3/t10-,13+/m0/s1
InChIKeySHNBJOFBRKFCLJ-GXFFZTMASA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol?
The IUPAC name of [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol (CID 59551270) is [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol.
What is the SMILES notation for [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol?
The canonical SMILES for [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol is CN1C[C@]2(C[C@H]1CO)C(C)(C)C21CCC1.
What is the InChIKey of [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol?
The InChIKey is SHNBJOFBRKFCLJ-GXFFZTMASA-N. The full InChI is InChI=1S/C13H23NO/c1-11(2)12(5-4-6-12)13(11)7-10(8-15)14(3)9-13/h10,15H,4-9H2,1-3H3/t10-,13+/m0/s1.
What are the key properties of [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol?
[(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol has a molecular weight of 209.33 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R,8S)-7,10,10-trimethyl-7-azadispiro[3.0.45.14]decan-8-yl]methanol is sourced from PubChem (CID 59551270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).