2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol

C19H25NO — CID 82732445

IUPAC2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol
SMILESCCc1cccnc1C(O)Cc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C19H25NO/c1-5-15-7-6-12-20-18(15)17(21)13-14-8-10-16(11-9-14)19(2,3)4/h6-12,17,21H,5,13H2,1-4H3
InChIKeyIXHCPHNBFFZOSG-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.22
Rot. Bonds4

About 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol

2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol (PubChem CID 82732445) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol
PubChem CID82732445
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol
SMILESCCc1cccnc1C(O)Cc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C19H25NO/c1-5-15-7-6-12-20-18(15)17(21)13-14-8-10-16(11-9-14)19(2,3)4/h6-12,17,21H,5,13H2,1-4H3
InChIKeyIXHCPHNBFFZOSG-UHFFFAOYSA-N
XLogP4.22
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(3-ethyl-2-pyridinyl)-2-hydroxyethyl]phenol
CID 82730497
2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol
CID 65150147
2-(3-bromo-4-methoxyphenyl)-1-(3-ethyl-2-pyridinyl)ethanol
CID 82729946
2-(4-chloro-2-fluorophenyl)-1-(3-ethyl-2-pyridinyl)ethanol
CID 114855034
1-(3-ethyl-2-pyridinyl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanol
CID 82729587
2-(2,5-dimethylpyrazol-3-yl)-1-(3-ethyl-2-pyridinyl)ethanol
CID 82730481
2-(1,3-benzothiazol-2-yl)-1-(3-ethyl-2-pyridinyl)ethanol
CID 82731383
1-(3-ethyl-2-pyridinyl)hex-4-yn-1-ol
CID 104804228
[2-(4-tert-butylphenyl)-1-(3-chloro-2-pyridinyl)ethyl]hydrazine
CID 103445951
3-ethyl-1-(3-ethyl-2-pyridinyl)heptan-1-ol
CID 82729718
(4-ethylcyclohexyl)-(3-ethyl-2-pyridinyl)methanol
CID 82731157
2-(4-fluorophenyl)-1-(3-methoxy-2-pyridinyl)ethanol
CID 114053745

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol?
The IUPAC name of 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol (CID 82732445) is 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol?
The canonical SMILES for 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol is CCc1cccnc1C(O)Cc1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol?
The InChIKey is IXHCPHNBFFZOSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-5-15-7-6-12-20-18(15)17(21)13-14-8-10-16(11-9-14)19(2,3)4/h6-12,17,21H,5,13H2,1-4H3.
What are the key properties of 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol?
2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol has a molecular weight of 283.42 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol is sourced from PubChem (CID 82732445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).