2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol

C18H23NO — CID 79740203

IUPAC2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol
SMILESCCc1ccc(CC(C)(O)c2ccc(C)c(C)c2)nc1
InChIInChI=1S/C18H23NO/c1-5-15-7-9-17(19-12-15)11-18(4,20)16-8-6-13(2)14(3)10-16/h6-10,12,20H,5,11H2,1-4H3
InChIKeyZGGIOMSUEYMCTF-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.71
Rot. Bonds4

About 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol

2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol (PubChem CID 79740203) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol
PubChem CID79740203
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol
SMILESCCc1ccc(CC(C)(O)c2ccc(C)c(C)c2)nc1
InChIInChI=1S/C18H23NO/c1-5-15-7-9-17(19-12-15)11-18(4,20)16-8-6-13(2)14(3)10-16/h6-10,12,20H,5,11H2,1-4H3
InChIKeyZGGIOMSUEYMCTF-UHFFFAOYSA-N
XLogP3.71
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol
CID 79739586
1-(5-ethyl-2-pyridinyl)-2-(4-methylphenyl)propan-2-ol
CID 79740506
3-[1-(5-ethyl-2-pyridinyl)-2-hydroxypropan-2-yl]benzonitrile
CID 115481461
1-(5-ethyl-2-pyridinyl)-2-(furan-3-yl)propan-2-ol
CID 113315423
2-(2-bromophenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol
CID 79740509
1-(3,4-difluorophenyl)-2-(3,4-dimethylphenyl)propan-2-ol
CID 82920068
2-(4-bromophenyl)-1-(3,4-dimethylphenyl)propan-2-ol
CID 63406671
1-(5-ethyl-2-pyridinyl)-2-(3-fluorophenyl)butan-2-ol
CID 114872587
ethane;1-(5-methyl-2-pyridinyl)-2-phenylpropan-2-ol
CID 144927641
2-(3,4-dimethylphenyl)-1-(1-propylimidazol-2-yl)propan-2-ol
CID 79744402
1-(3,4-dimethylphenyl)-2-(4-ethylphenyl)propan-2-amine
CID 63408206
1-(5-ethyl-2-pyridinyl)-3,3-dimethylbutan-2-one
CID 79745157

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol?
The IUPAC name of 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol (CID 79740203) is 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol?
The canonical SMILES for 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol is CCc1ccc(CC(C)(O)c2ccc(C)c(C)c2)nc1.
What is the InChIKey of 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol?
The InChIKey is ZGGIOMSUEYMCTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-5-15-7-9-17(19-12-15)11-18(4,20)16-8-6-13(2)14(3)10-16/h6-10,12,20H,5,11H2,1-4H3.
What are the key properties of 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol?
2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol has a molecular weight of 269.39 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-1-(5-ethyl-2-pyridinyl)propan-2-ol is sourced from PubChem (CID 79740203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).