1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one

C19H24O2 — CID 126621331

IUPAC1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one
SMILESO=C(CC1C2CCC3CC1CC3C2)C(O)c1ccccc1
InChIInChI=1S/C19H24O2/c20-18(19(21)12-4-2-1-3-5-12)11-17-14-7-6-13-8-16(17)10-15(13)9-14/h1-5,13-17,19,21H,6-11H2
InChIKeyDXYBSLMNPMKMPR-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.75
Rot. Bonds4

About 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one

1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one (PubChem CID 126621331) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one.

Molecular Properties

Compound Name1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one
PubChem CID126621331
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one
SMILESO=C(CC1C2CCC3CC1CC3C2)C(O)c1ccccc1
InChIInChI=1S/C19H24O2/c20-18(19(21)12-4-2-1-3-5-12)11-17-14-7-6-13-8-16(17)10-15(13)9-14/h1-5,13-17,19,21H,6-11H2
InChIKeyDXYBSLMNPMKMPR-UHFFFAOYSA-N
XLogP3.75
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-hydroxy-3-(oxan-4-yl)-1-phenylpropan-2-one
CID 103458193
1-(4-ethyl-9-tricyclo[3.3.2.03,7]decanyl)-2-hydroxy-2-phenylethanone
CID 126607643
(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide
CID 129445975
(2R)-2-hydroxy-2-phenylacetic acid
CID 139040954
2-((1,2,3,4,5,6-13C6)cyclohexatrienyl)-2-hydroxyacetic acid
CID 11019130
1-hydroxy-4,4-dimethyl-1-phenylpentan-2-one
CID 58128890
(5R)-5-hydroxy-4-oxo-5-phenylpentanoate
CID 102191260
cyclopentanecarbaldehyde;2-hydroxy-2-phenylacetic acid
CID 87781655
(2S)-2-hydroxy-2-phenylacetic acid;hydrochloride
CID 141322731
(2S)-2-hydroxy-2-phenylacetic acid;hydrate
CID 139987845
(2R)-2-hydroxy-2-phenylacetic acid;hydrate
CID 69001631
(2R)-2-hydroxy-2-phenylacetic acid;rhodium
CID 174857137

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one?
The IUPAC name of 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one (CID 126621331) is 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one.
What is the SMILES notation for 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one?
The canonical SMILES for 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one is O=C(CC1C2CCC3CC1CC3C2)C(O)c1ccccc1.
What is the InChIKey of 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one?
The InChIKey is DXYBSLMNPMKMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c20-18(19(21)12-4-2-1-3-5-12)11-17-14-7-6-13-8-16(17)10-15(13)9-14/h1-5,13-17,19,21H,6-11H2.
What are the key properties of 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one?
1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one has a molecular weight of 284.40 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-phenyl-3-(10-tricyclo[4.3.1.03,8]decanyl)propan-2-one is sourced from PubChem (CID 126621331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).