1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone

C10H14N2O — CID 83827922

IUPAC1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone
SMILESCCc1ccc(C(=O)CNC)cn1
InChIInChI=1S/C10H14N2O/c1-3-9-5-4-8(6-12-9)10(13)7-11-2/h4-6,11H,3,7H2,1-2H3
InChIKeyLGSHIIVELQCJFI-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.05
Rot. Bonds4

About 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone

1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone (PubChem CID 83827922) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone.

Molecular Properties

Compound Name1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone
PubChem CID83827922
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone
SMILESCCc1ccc(C(=O)CNC)cn1
InChIInChI=1S/C10H14N2O/c1-3-9-5-4-8(6-12-9)10(13)7-11-2/h4-6,11H,3,7H2,1-2H3
InChIKeyLGSHIIVELQCJFI-UHFFFAOYSA-N
XLogP1.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-1-(6-ethyl-3-pyridinyl)ethanone
CID 126484082
2-(methylamino)-1-(6-methyl-3-pyridinyl)ethanone
CID 82596607
1-(3,4-diethoxyphenyl)-2-(methylamino)ethanone
CID 116553831
ethane;6-ethyl-N-methylpyridin-3-amine
CID 142596426
1-(2-chloro-4-pyridinyl)-2-(methylamino)ethanone
CID 82655374
2-(methylamino)-1-quinolin-6-ylethanone
CID 84669481
1-(3-amino-4-ethoxyphenyl)-2-(methylamino)ethanone
CID 82258591
1-[4-fluoro-3-(hydroxymethyl)phenyl]-2-(methylamino)ethanone
CID 117286820
2-(methylamino)-1-(1-methylpyrazol-4-yl)ethanone
CID 82595196
1-[4-(1,2-dihydroxyethyl)phenyl]-2-(methylamino)ethanone
CID 117298432
N-[(6-ethyl-3-pyridinyl)sulfinyl]propanamide
CID 156713382
1-[3,4-bis(methylsulfanyl)phenyl]-2-(methylamino)ethanone
CID 117355944

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone?
The IUPAC name of 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone (CID 83827922) is 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone.
What is the SMILES notation for 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone?
The canonical SMILES for 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone is CCc1ccc(C(=O)CNC)cn1.
What is the InChIKey of 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone?
The InChIKey is LGSHIIVELQCJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-3-9-5-4-8(6-12-9)10(13)7-11-2/h4-6,11H,3,7H2,1-2H3.
What are the key properties of 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone?
1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone has a molecular weight of 178.23 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethyl-3-pyridinyl)-2-(methylamino)ethanone is sourced from PubChem (CID 83827922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).