2-amino-1-quinolin-2-ylethanone

C11H10N2O — CID 23532024

IUPAC2-amino-1-quinolin-2-ylethanone
SMILESNCC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C11H10N2O/c12-7-11(14)10-6-5-8-3-1-2-4-9(8)13-10/h1-6H,7,12H2
InChIKeyVYEPLLPXYIXVNO-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.38
Rot. Bonds2

About 2-amino-1-quinolin-2-ylethanone

2-amino-1-quinolin-2-ylethanone (PubChem CID 23532024) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-amino-1-quinolin-2-ylethanone.

Molecular Properties

Compound Name2-amino-1-quinolin-2-ylethanone
PubChem CID23532024
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2-amino-1-quinolin-2-ylethanone
SMILESNCC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C11H10N2O/c12-7-11(14)10-6-5-8-3-1-2-4-9(8)13-10/h1-6H,7,12H2
InChIKeyVYEPLLPXYIXVNO-UHFFFAOYSA-N
XLogP1.38
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-di(quinolin-2-yl)ethanone
CID 24973307
1-quinolin-2-ylbutan-1-one
CID 14895778
quinoline-2-carboxamide;hydrobromide
CID 141009871
iridium(3+);tris(quinoline-2-carboxylate)
CID 161052613
3-methyl-1-quinolin-2-ylbut-3-en-1-one
CID 79177139
1-quinolin-2-ylpent-4-yn-1-one
CID 63656915
copper;quinoline-2-carboxylic acid
CID 68537473
europium;quinoline-2-carboxylic acid
CID 87730482
3-methylsulfonyl-1-quinolin-2-ylpropan-1-one
CID 63222455
2-(4-chlorophenyl)-1-quinolin-2-ylethanone
CID 63222375
2-(4-ethylphenyl)-1-quinolin-2-ylethanone
CID 63409967
chromium(3+);tris(quinoline-2-carboxylate)
CID 86616048

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-quinolin-2-ylethanone?
The IUPAC name of 2-amino-1-quinolin-2-ylethanone (CID 23532024) is 2-amino-1-quinolin-2-ylethanone.
What is the SMILES notation for 2-amino-1-quinolin-2-ylethanone?
The canonical SMILES for 2-amino-1-quinolin-2-ylethanone is NCC(=O)c1ccc2ccccc2n1.
What is the InChIKey of 2-amino-1-quinolin-2-ylethanone?
The InChIKey is VYEPLLPXYIXVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c12-7-11(14)10-6-5-8-3-1-2-4-9(8)13-10/h1-6H,7,12H2.
What are the key properties of 2-amino-1-quinolin-2-ylethanone?
2-amino-1-quinolin-2-ylethanone has a molecular weight of 186.21 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-quinolin-2-ylethanone is sourced from PubChem (CID 23532024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).