N-(2-aminoethyl)-2-quinolin-2-ylacetamide

C13H15N3O — CID 110464134

IUPACN-(2-aminoethyl)-2-quinolin-2-ylacetamide
SMILESNCCNC(=O)Cc1ccc2ccccc2n1
InChIInChI=1S/C13H15N3O/c14-7-8-15-13(17)9-11-6-5-10-3-1-2-4-12(10)16-11/h1-6H,7-9,14H2,(H,15,17)
InChIKeyOSXMXKMSOCZDGE-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.85
Rot. Bonds4

About N-(2-aminoethyl)-2-quinolin-2-ylacetamide

N-(2-aminoethyl)-2-quinolin-2-ylacetamide (PubChem CID 110464134) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-quinolin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-quinolin-2-ylacetamide
PubChem CID110464134
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-(2-aminoethyl)-2-quinolin-2-ylacetamide
SMILESNCCNC(=O)Cc1ccc2ccccc2n1
InChIInChI=1S/C13H15N3O/c14-7-8-15-13(17)9-11-6-5-10-3-1-2-4-12(10)16-11/h1-6H,7-9,14H2,(H,15,17)
InChIKeyOSXMXKMSOCZDGE-UHFFFAOYSA-N
XLogP0.85
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-2-(7-chloroquinolin-2-yl)acetamide
CID 110490287
N-(2-pyrazol-1-ylethyl)-2-quinolin-2-ylacetamide
CID 110473747
2-naphthalen-2-yl-N-(2-quinolin-2-ylethyl)acetamide
CID 71940496
4-amino-3-methyl-1-quinolin-2-ylbutan-2-one
CID 116564666
3-hydroxy-2-[(2-quinolin-2-ylacetyl)amino]propanoic acid
CID 110464190
2-quinolin-2-ylacetic acid;hydrate
CID 141421012
8-amino-1-quinolin-2-yloctan-2-one
CID 116551634
N-cyclohexyl-2-quinolin-2-ylacetamide
CID 110464171
1-[4-(aminomethyl)phenyl]-2-quinolin-2-ylethanone
CID 116548351
2-(6-aminoquinolin-2-yl)-N-(2-hydroxyethyl)acetamide
CID 82547456
1,2-di(quinolin-2-yl)ethanone
CID 24973307
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-quinolin-2-ylacetamide?
The IUPAC name of N-(2-aminoethyl)-2-quinolin-2-ylacetamide (CID 110464134) is N-(2-aminoethyl)-2-quinolin-2-ylacetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-quinolin-2-ylacetamide?
The canonical SMILES for N-(2-aminoethyl)-2-quinolin-2-ylacetamide is NCCNC(=O)Cc1ccc2ccccc2n1.
What is the InChIKey of N-(2-aminoethyl)-2-quinolin-2-ylacetamide?
The InChIKey is OSXMXKMSOCZDGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c14-7-8-15-13(17)9-11-6-5-10-3-1-2-4-12(10)16-11/h1-6H,7-9,14H2,(H,15,17).
What are the key properties of N-(2-aminoethyl)-2-quinolin-2-ylacetamide?
N-(2-aminoethyl)-2-quinolin-2-ylacetamide has a molecular weight of 229.28 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-quinolin-2-ylacetamide is sourced from PubChem (CID 110464134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).