1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol

C17H16N2O — CID 106756244

IUPAC1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol
SMILESCc1cc(C(O)Cc2ccc3ccccc3n2)ccn1
InChIInChI=1S/C17H16N2O/c1-12-10-14(8-9-18-12)17(20)11-15-7-6-13-4-2-3-5-16(13)19-15/h2-10,17,20H,11H2,1H3
InChIKeyPXOKFAMIEBPWIZ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.21
Rot. Bonds3

About 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol

1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol (PubChem CID 106756244) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol.

Molecular Properties

Compound Name1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol
PubChem CID106756244
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol
SMILESCc1cc(C(O)Cc2ccc3ccccc3n2)ccn1
InChIInChI=1S/C17H16N2O/c1-12-10-14(8-9-18-12)17(20)11-15-7-6-13-4-2-3-5-16(13)19-15/h2-10,17,20H,11H2,1H3
InChIKeyPXOKFAMIEBPWIZ-UHFFFAOYSA-N
XLogP3.21
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-phenyl-2-quinolin-2-ylethanol
CID 92849987
3-(1-hydroxy-2-quinolin-2-ylethyl)benzonitrile
CID 115481180
2-(1-ethylbenzimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanol
CID 106756272
2-(3-methylphenyl)-1-(2-methyl-4-pyridinyl)ethanol
CID 106756085
2-quinolin-2-yl-1-[4-(trifluoromethyl)phenyl]ethanol
CID 2778952
1-(2-methyl-4-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol
CID 106756289
1-(2,5-dichlorothiophen-3-yl)-2-quinolin-2-ylethanol
CID 107967248
2-[2-(4-methylphenyl)-3-quinolin-2-ylpropyl]quinoline
CID 132563536
(2S,3S)-3-[(2R)-1-quinolin-2-ylpropan-2-yl]sulfanylbutan-2-ol
CID 98792339
(2R,3R)-3-[(2R)-1-quinolin-2-ylpropan-2-yl]sulfanylbutan-2-ol
CID 97087782
2-[2-bromo-2-(3,5-dimethylphenyl)ethyl]quinoline
CID 66461439
1-(5-chloro-1,3-thiazol-2-yl)-2-quinolin-2-ylethanol
CID 107124923

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol?
The IUPAC name of 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol (CID 106756244) is 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol.
What is the SMILES notation for 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol?
The canonical SMILES for 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol is Cc1cc(C(O)Cc2ccc3ccccc3n2)ccn1.
What is the InChIKey of 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol?
The InChIKey is PXOKFAMIEBPWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12-10-14(8-9-18-12)17(20)11-15-7-6-13-4-2-3-5-16(13)19-15/h2-10,17,20H,11H2,1H3.
What are the key properties of 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol?
1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol has a molecular weight of 264.33 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-4-pyridinyl)-2-quinolin-2-ylethanol is sourced from PubChem (CID 106756244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).