2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol

C19H25N3O2 — CID 141137926

IUPAC2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol
SMILESCOc1ccc2cccc(C(O)CN3C4CCC3CC(N)C4)c2n1
InChIInChI=1S/C19H25N3O2/c1-24-18-8-5-12-3-2-4-16(19(12)21-18)17(23)11-22-14-6-7-15(22)10-13(20)9-14/h2-5,8,13-15,17,23H,6-7,9-11,20H2,1H3
InChIKeyNZRFRSNCFSOHAS-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.23
Rot. Bonds4

About 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol

2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol (PubChem CID 141137926) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol.

Molecular Properties

Compound Name2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol
PubChem CID141137926
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol
SMILESCOc1ccc2cccc(C(O)CN3C4CCC3CC(N)C4)c2n1
InChIInChI=1S/C19H25N3O2/c1-24-18-8-5-12-3-2-4-16(19(12)21-18)17(23)11-22-14-6-7-15(22)10-13(20)9-14/h2-5,8,13-15,17,23H,6-7,9-11,20H2,1H3
InChIKeyNZRFRSNCFSOHAS-UHFFFAOYSA-N
XLogP2.23
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol with MolForge

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Related Compounds

2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(3-methoxyquinolin-5-yl)ethanol
CID 69377865
2-amino-2-(2-methoxyquinolin-8-yl)ethanol
CID 67131015
2-[3-[(2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-ylmethylamino)methyl]piperidin-1-yl]-1-(2-methoxyquinolin-8-yl)ethanol
CID 58989684
2-[3-(2,1,3-benzoxadiazol-5-ylmethylamino)-8-azabicyclo[3.2.1]octan-8-yl]-1-(6-methoxy-1,5-naphthyridin-4-yl)ethanol
CID 58989677
4-amino-1-[2-(2-methoxyquinolin-8-yl)ethyl]cyclohexan-1-ol
CID 68696675
6-[[[8-[2-hydroxy-2-(3-methoxyquinoxalin-5-yl)ethyl]-8-azabicyclo[3.2.1]octan-3-yl]amino]methyl]-4H-1,4-benzoxazin-3-one
CID 58989649
[1-[2-hydroxy-2-(3-methoxyquinoxalin-5-yl)ethyl]piperidin-4-yl]carbamic acid
CID 69063193
2-methoxyquinoline-8-thiol
CID 25146782
6-[[[(3R,4S)-3-fluoro-1-[(2R)-2-hydroxy-2-(2-methoxyquinolin-8-yl)ethyl]piperidin-4-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one;dihydrochloride
CID 69058901
6-[[[8-[2-(7-chloro-2-methoxyquinolin-8-yl)-2-hydroxyethyl]-8-azabicyclo[3.2.1]octan-3-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one
CID 58989645
1-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)butan-2-ol
CID 61233729
6-[[[8-[(2R)-2-hydroxy-2-(6-methoxy-1,5-naphthyridin-4-yl)ethyl]-8-azabicyclo[3.2.1]octan-3-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one;hydrochloride
CID 45481000

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol?
The IUPAC name of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol (CID 141137926) is 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol.
What is the SMILES notation for 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol?
The canonical SMILES for 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol is COc1ccc2cccc(C(O)CN3C4CCC3CC(N)C4)c2n1.
What is the InChIKey of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol?
The InChIKey is NZRFRSNCFSOHAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-24-18-8-5-12-3-2-4-16(19(12)21-18)17(23)11-22-14-6-7-15(22)10-13(20)9-14/h2-5,8,13-15,17,23H,6-7,9-11,20H2,1H3.
What are the key properties of 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol?
2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol has a molecular weight of 327.43 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2-methoxyquinolin-8-yl)ethanol is sourced from PubChem (CID 141137926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).