3,3-diethyl-1-phenylpentan-2-ol

C15H24O — CID 141275578

IUPAC3,3-diethyl-1-phenylpentan-2-ol
SMILESCCC(CC)(CC)C(O)Cc1ccccc1
InChIInChI=1S/C15H24O/c1-4-15(5-2,6-3)14(16)12-13-10-8-7-9-11-13/h7-11,14,16H,4-6,12H2,1-3H3
InChIKeyBUQJFVUPVAFNDT-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.81
Rot. Bonds6

About 3,3-diethyl-1-phenylpentan-2-ol

3,3-diethyl-1-phenylpentan-2-ol (PubChem CID 141275578) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 3,3-diethyl-1-phenylpentan-2-ol.

Molecular Properties

Compound Name3,3-diethyl-1-phenylpentan-2-ol
PubChem CID141275578
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name3,3-diethyl-1-phenylpentan-2-ol
SMILESCCC(CC)(CC)C(O)Cc1ccccc1
InChIInChI=1S/C15H24O/c1-4-15(5-2,6-3)14(16)12-13-10-8-7-9-11-13/h7-11,14,16H,4-6,12H2,1-3H3
InChIKeyBUQJFVUPVAFNDT-UHFFFAOYSA-N
XLogP3.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-3-methoxy-1-phenylpentan-2-ol
CID 116752734
(2S)-3,3-dimethyl-1-phenylbutan-2-ol
CID 12689722
3,3-dimethyl-1-phenylbutan-2-ol
CID 5051506
3-ethoxy-3-ethyl-1-phenylpentan-2-ol
CID 116752448
acetic acid;1,1,1-trichloro-3-phenylpropan-2-ol
CID 174431181
(3S)-2-benzyl-4-phenylbutane-1,2,3-triol
CID 66810886
2,3-dihydroxy-2-methyl-4-phenylbutanoic acid
CID 77254762
1,6-diphenylhexane-2,5-diol
CID 15072586
3-methyl-1-phenylhexane-2,3,5-triol
CID 141215630
(2S,3S)-3-methyl-4-phenylbutan-2-ol
CID 11194521
2-ethylbutylbenzene;methane
CID 158777195
1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol
CID 63085891

Frequently Asked Questions

What is the IUPAC name of 3,3-diethyl-1-phenylpentan-2-ol?
The IUPAC name of 3,3-diethyl-1-phenylpentan-2-ol (CID 141275578) is 3,3-diethyl-1-phenylpentan-2-ol.
What is the SMILES notation for 3,3-diethyl-1-phenylpentan-2-ol?
The canonical SMILES for 3,3-diethyl-1-phenylpentan-2-ol is CCC(CC)(CC)C(O)Cc1ccccc1.
What is the InChIKey of 3,3-diethyl-1-phenylpentan-2-ol?
The InChIKey is BUQJFVUPVAFNDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-4-15(5-2,6-3)14(16)12-13-10-8-7-9-11-13/h7-11,14,16H,4-6,12H2,1-3H3.
What are the key properties of 3,3-diethyl-1-phenylpentan-2-ol?
3,3-diethyl-1-phenylpentan-2-ol has a molecular weight of 220.36 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethyl-1-phenylpentan-2-ol is sourced from PubChem (CID 141275578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).