2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide

C15H19N3O2 — CID 82547311

IUPAC2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCC(CO)NC(=O)Cc1ccc2cc(N)ccc2n1
InChIInChI=1S/C15H19N3O2/c1-2-12(9-19)18-15(20)8-13-5-3-10-7-11(16)4-6-14(10)17-13/h3-7,12,19H,2,8-9,16H2,1H3,(H,18,20)
InChIKeyFZUDWGLKODBWBW-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.25
Rot. Bonds5

About 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide

2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide (PubChem CID 82547311) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide
PubChem CID82547311
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCC(CO)NC(=O)Cc1ccc2cc(N)ccc2n1
InChIInChI=1S/C15H19N3O2/c1-2-12(9-19)18-15(20)8-13-5-3-10-7-11(16)4-6-14(10)17-13/h3-7,12,19H,2,8-9,16H2,1H3,(H,18,20)
InChIKeyFZUDWGLKODBWBW-UHFFFAOYSA-N
XLogP1.25
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(6-aminoquinolin-2-yl)-N-(2-hydroxyethyl)acetamide
CID 82547456
2-[[2-(6-aminoquinolin-2-yl)acetyl]amino]acetic acid
CID 82547405
2-(6-aminoquinolin-2-yl)-N-[2-(dimethylamino)ethyl]acetamide
CID 82547358
2-(6-aminoquinolin-2-yl)-N-(4-methylpiperazin-1-yl)acetamide
CID 82546933
2-(6-aminoquinolin-2-yl)-N-[2-(2-hydroxyethoxy)ethyl]acetamide
CID 82547092
2-(6-aminoquinolin-2-yl)-N-(2,3,4-trifluorophenyl)acetamide
CID 110451369
2-(6-aminoquinolin-2-yl)-N-(5-chloro-2-hydroxyphenyl)acetamide
CID 110451337
(6-aminoquinolin-2-yl)methanol
CID 22763701
2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide
CID 107339685
2-(6-aminoquinolin-2-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 82547221
2-propylquinolin-6-amine
CID 130537701
N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide
CID 103961002

Frequently Asked Questions

What is the IUPAC name of 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide?
The IUPAC name of 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide (CID 82547311) is 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide.
What is the SMILES notation for 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide?
The canonical SMILES for 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide is CCC(CO)NC(=O)Cc1ccc2cc(N)ccc2n1.
What is the InChIKey of 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide?
The InChIKey is FZUDWGLKODBWBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-12(9-19)18-15(20)8-13-5-3-10-7-11(16)4-6-14(10)17-13/h3-7,12,19H,2,8-9,16H2,1H3,(H,18,20).
What are the key properties of 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide?
2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 1.25, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-aminoquinolin-2-yl)-N-(1-hydroxybutan-2-yl)acetamide is sourced from PubChem (CID 82547311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).