1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol

C15H20O2 — CID 10263352

IUPAC1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol
SMILESOC1([C@@H]2C3(CC3)C23[C@@H](C2(O)CC2)C32CC2)CC1
InChIInChI=1S/C15H20O2/c16-13(5-6-13)9-11(1-2-11)15(9)10(12(15)3-4-12)14(17)7-8-14/h9-10,16-17H,1-8H2/t9-,10+,15?
InChIKeyZZAAIAFOXFLJOQ-WYPFBEBGSA-N
MW232.32 g/mol
LogP1.84
Rot. Bonds2

About 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol

1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol (PubChem CID 10263352) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol
PubChem CID10263352
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol
SMILESOC1([C@@H]2C3(CC3)C23[C@@H](C2(O)CC2)C32CC2)CC1
InChIInChI=1S/C15H20O2/c16-13(5-6-13)9-11(1-2-11)15(9)10(12(15)3-4-12)14(17)7-8-14/h9-10,16-17H,1-8H2/t9-,10+,15?
InChIKeyZZAAIAFOXFLJOQ-WYPFBEBGSA-N
XLogP1.84
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol?
The IUPAC name of 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol (CID 10263352) is 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol.
What is the SMILES notation for 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol?
The canonical SMILES for 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol is OC1([C@@H]2C3(CC3)C23[C@@H](C2(O)CC2)C32CC2)CC1.
What is the InChIKey of 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol?
The InChIKey is ZZAAIAFOXFLJOQ-WYPFBEBGSA-N. The full InChI is InChI=1S/C15H20O2/c16-13(5-6-13)9-11(1-2-11)15(9)10(12(15)3-4-12)14(17)7-8-14/h9-10,16-17H,1-8H2/t9-,10+,15?.
What are the key properties of 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol?
1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol has a molecular weight of 232.32 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(8R,9S)-8-(1-hydroxycyclopropyl)trispiro[2.0.0.25.14.13]nonan-9-yl]cyclopropan-1-ol is sourced from PubChem (CID 10263352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).