[(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol

C16H21N3O2 — CID 97177742

IUPAC[(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol
SMILESCCOc1nc2ccccc2nc1N1CCCC[C@@H]1CO
InChIInChI=1S/C16H21N3O2/c1-2-21-16-15(19-10-6-5-7-12(19)11-20)17-13-8-3-4-9-14(13)18-16/h3-4,8-9,12,20H,2,5-7,10-11H2,1H3/t12-/m1/s1
InChIKeyLVVSVIICDXPIQZ-GFCCVEGCSA-N
MW287.36 g/mol
LogP2.38
Rot. Bonds4

About [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol

[(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol (PubChem CID 97177742) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol
PubChem CID97177742
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name[(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol
SMILESCCOc1nc2ccccc2nc1N1CCCC[C@@H]1CO
InChIInChI=1S/C16H21N3O2/c1-2-21-16-15(19-10-6-5-7-12(19)11-20)17-13-8-3-4-9-14(13)18-16/h3-4,8-9,12,20H,2,5-7,10-11H2,1H3/t12-/m1/s1
InChIKeyLVVSVIICDXPIQZ-GFCCVEGCSA-N
XLogP2.38
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanamine;hydrochloride
CID 71639684
[1-(3-methoxyquinoxalin-2-yl)pyrrolidin-2-yl]methanol
CID 71648493
(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidine-2-carboxylic acid
CID 97177738
tert-butyl N-[[(2S)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methyl]carbamate
CID 97177741
[(2R)-1-[3-(cyclopropylamino)quinoxalin-2-yl]pyrrolidin-2-yl]methanol
CID 97169661
[1-[3-(aminomethyl)quinolin-2-yl]azepan-2-yl]methanol
CID 116634094
(3S)-1-(3-ethoxyquinoxalin-2-yl)piperidine-3-carboxylic acid
CID 97177724
N-cyclohexyl-1-(3-ethoxyquinoxalin-2-yl)piperidine-3-carboxamide
CID 50752811
tert-butyl N-[[1-(3-methoxyquinoxalin-2-yl)piperidin-2-yl]methyl]carbamate
CID 71648495
2-[(2S)-2-(hydroxymethyl)piperidin-1-yl]pyridin-3-ol
CID 97169524
2-[2-(bromomethyl)azepan-1-yl]-3-methylquinoxaline
CID 116638816
(1-quinolin-4-ylpiperidin-2-yl)methanol
CID 61339741

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol?
The IUPAC name of [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol (CID 97177742) is [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol is CCOc1nc2ccccc2nc1N1CCCC[C@@H]1CO.
What is the InChIKey of [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol?
The InChIKey is LVVSVIICDXPIQZ-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-2-21-16-15(19-10-6-5-7-12(19)11-20)17-13-8-3-4-9-14(13)18-16/h3-4,8-9,12,20H,2,5-7,10-11H2,1H3/t12-/m1/s1.
What are the key properties of [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol?
[(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol has a molecular weight of 287.36 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(3-ethoxyquinoxalin-2-yl)piperidin-2-yl]methanol is sourced from PubChem (CID 97177742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).