2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol

C19H26N2O — CID 90669677

IUPAC2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol
SMILESCC(C)c1cc(C(O)CC2CCCCN2)c2ccccc2n1
InChIInChI=1S/C19H26N2O/c1-13(2)18-12-16(15-8-3-4-9-17(15)21-18)19(22)11-14-7-5-6-10-20-14/h3-4,8-9,12-14,19-20,22H,5-7,10-11H2,1-2H3
InChIKeySOHIMFHODYFBAZ-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.92
Rot. Bonds4

About 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol

2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol (PubChem CID 90669677) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol.

Molecular Properties

Compound Name2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol
PubChem CID90669677
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol
SMILESCC(C)c1cc(C(O)CC2CCCCN2)c2ccccc2n1
InChIInChI=1S/C19H26N2O/c1-13(2)18-12-16(15-8-3-4-9-17(15)21-18)19(22)11-14-7-5-6-10-20-14/h3-4,8-9,12-14,19-20,22H,5-7,10-11H2,1-2H3
InChIKeySOHIMFHODYFBAZ-UHFFFAOYSA-N
XLogP3.92
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-phenyl-2-[(2S)-piperidin-2-yl]ethanol
CID 10856632
(1R)-2-[(2R)-azepan-2-yl]-1-phenylethanol
CID 95788130
(1S)-2-[(2R)-azepan-2-yl]-1-phenylethanol
CID 95788131
1-(1,3-dichlorophenanthren-9-yl)-2-piperidin-2-ylethanol
CID 90668901
2-piperidin-2-yl-1-(2,3,6-trichlorophenanthren-9-yl)ethanol
CID 90668908
1-(2,5-dimethylphenyl)-2-piperidin-2-ylethanol
CID 79560663
2-(2-propan-2-ylquinolin-4-yl)acetic acid
CID 82081543
azepan-2-yl-(2-methylquinolin-4-yl)methanol
CID 79235774
2-piperidin-2-yl-1-[8-(trifluoromethyl)quinolin-4-yl]ethanol
CID 90669195
1-(1-benzofuran-2-yl)-2-pyrrolidin-2-ylethanol
CID 79559824
(2R)-1-[methyl(diphenyl)silyl]-3-[(2S)-piperidin-2-yl]propan-2-ol
CID 166022802
3,3-diphenyl-1-piperidin-2-ylbutan-2-ol
CID 22237347

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol?
The IUPAC name of 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol (CID 90669677) is 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol.
What is the SMILES notation for 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol?
The canonical SMILES for 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol is CC(C)c1cc(C(O)CC2CCCCN2)c2ccccc2n1.
What is the InChIKey of 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol?
The InChIKey is SOHIMFHODYFBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-13(2)18-12-16(15-8-3-4-9-17(15)21-18)19(22)11-14-7-5-6-10-20-14/h3-4,8-9,12-14,19-20,22H,5-7,10-11H2,1-2H3.
What are the key properties of 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol?
2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol has a molecular weight of 298.43 g/mol, XLogP of 3.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-1-(2-propan-2-ylquinolin-4-yl)ethanol is sourced from PubChem (CID 90669677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).