3-amino-2-quinolin-5-yloxybutan-1-ol

C13H16N2O2 — CID 103044560

IUPAC3-amino-2-quinolin-5-yloxybutan-1-ol
SMILESCC(N)C(CO)Oc1cccc2ncccc12
InChIInChI=1S/C13H16N2O2/c1-9(14)13(8-16)17-12-6-2-5-11-10(12)4-3-7-15-11/h2-7,9,13,16H,8,14H2,1H3
InChIKeyCZPOJJSHIJVGOC-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.32
Rot. Bonds4

About 3-amino-2-quinolin-5-yloxybutan-1-ol

3-amino-2-quinolin-5-yloxybutan-1-ol (PubChem CID 103044560) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 3-amino-2-quinolin-5-yloxybutan-1-ol.

Molecular Properties

Compound Name3-amino-2-quinolin-5-yloxybutan-1-ol
PubChem CID103044560
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name3-amino-2-quinolin-5-yloxybutan-1-ol
SMILESCC(N)C(CO)Oc1cccc2ncccc12
InChIInChI=1S/C13H16N2O2/c1-9(14)13(8-16)17-12-6-2-5-11-10(12)4-3-7-15-11/h2-7,9,13,16H,8,14H2,1H3
InChIKeyCZPOJJSHIJVGOC-UHFFFAOYSA-N
XLogP1.32
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-1-quinolin-5-yloxypropan-2-amine
CID 103044219
(1R)-1-quinolin-5-ylethanamine
CID 55277010
3-amino-2-(2-propan-2-ylphenoxy)butan-1-ol
CID 64898304
2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile
CID 103045526
3-(methylamino)-4-quinolin-5-yloxybutan-1-ol
CID 103044503
N-propyl-3-quinolin-5-yloxybutan-2-amine
CID 103044558
O-quinolin-5-ylhydroxylamine;hydrochloride
CID 162421843
5-(3-bromo-2-methylpropoxy)quinoline
CID 103044584
3-methoxy-N-propan-2-yl-2-quinolin-5-yloxypropan-1-amine
CID 103229133
quinolin-5-yloxyphosphonamidous acid
CID 175462416
N-(2-methylpropyl)-2-quinolin-5-yloxypentan-1-amine
CID 103045732
(1R)-1-(5-quinolin-5-yloxy-2-pyridinyl)ethanamine
CID 103044923

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-quinolin-5-yloxybutan-1-ol?
The IUPAC name of 3-amino-2-quinolin-5-yloxybutan-1-ol (CID 103044560) is 3-amino-2-quinolin-5-yloxybutan-1-ol.
What is the SMILES notation for 3-amino-2-quinolin-5-yloxybutan-1-ol?
The canonical SMILES for 3-amino-2-quinolin-5-yloxybutan-1-ol is CC(N)C(CO)Oc1cccc2ncccc12.
What is the InChIKey of 3-amino-2-quinolin-5-yloxybutan-1-ol?
The InChIKey is CZPOJJSHIJVGOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-9(14)13(8-16)17-12-6-2-5-11-10(12)4-3-7-15-11/h2-7,9,13,16H,8,14H2,1H3.
What are the key properties of 3-amino-2-quinolin-5-yloxybutan-1-ol?
3-amino-2-quinolin-5-yloxybutan-1-ol has a molecular weight of 232.28 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-quinolin-5-yloxybutan-1-ol is sourced from PubChem (CID 103044560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).