2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide

C13H15N3O — CID 81427166

IUPAC2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide
SMILESCNCC(=O)NCc1cccc2cccnc12
InChIInChI=1S/C13H15N3O/c1-14-9-12(17)16-8-11-5-2-4-10-6-3-7-15-13(10)11/h2-7,14H,8-9H2,1H3,(H,16,17)
InChIKeyCSUSILQNDZGDLN-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.07
Rot. Bonds4

About 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide

2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide (PubChem CID 81427166) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide
PubChem CID81427166
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide
SMILESCNCC(=O)NCc1cccc2cccnc12
InChIInChI=1S/C13H15N3O/c1-14-9-12(17)16-8-11-5-2-4-10-6-3-7-15-13(10)11/h2-7,14H,8-9H2,1H3,(H,16,17)
InChIKeyCSUSILQNDZGDLN-UHFFFAOYSA-N
XLogP1.07
TPSA54.02 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 ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(quinolin-8-ylmethyl)-2-sulfanylacetamide
CID 81423056
2-methoxy-N-(quinolin-8-ylmethyl)acetamide
CID 47468683
bis(N-methyl-1-quinolin-8-ylmethanamine);oxalic acid
CID 121229149
3-(propan-2-ylamino)-N-(quinolin-8-ylmethyl)propanamide
CID 81427173
3-(tert-butylamino)-N-(quinolin-8-ylmethyl)propanamide
CID 81427105
N-(cyanomethyl)-2-(quinolin-8-ylmethylamino)acetamide
CID 81427388
2-amino-N-(quinolin-8-ylmethyl)propanamide
CID 81427001
N-[(2-chlorophenyl)methyl]-2-quinolin-8-ylacetamide
CID 51307001
N-(2-methoxyethyl)-2-(quinolin-8-ylmethylamino)acetamide
CID 112723633
N-(2-cyanoethyl)-2-(quinolin-8-ylmethylamino)acetamide
CID 81427738
2-hydrazinyl-2-oxo-N-(quinolin-8-ylmethyl)acetamide
CID 69377520
2-bromo-3-methyl-N-(quinolin-8-ylmethyl)butanamide
CID 81428744

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide (CID 81427166) is 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide is CNCC(=O)NCc1cccc2cccnc12.
What is the InChIKey of 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide?
The InChIKey is CSUSILQNDZGDLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-14-9-12(17)16-8-11-5-2-4-10-6-3-7-15-13(10)11/h2-7,14H,8-9H2,1H3,(H,16,17).
What are the key properties of 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide?
2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide has a molecular weight of 229.28 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(quinolin-8-ylmethyl)acetamide is sourced from PubChem (CID 81427166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).