1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone

C13H20N2O — CID 177246197

IUPAC1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone
SMILESCCCN(CC)c1ccc(C(C)=O)nc1C
InChIInChI=1S/C13H20N2O/c1-5-9-15(6-2)13-8-7-12(11(4)16)14-10(13)3/h7-8H,5-6,9H2,1-4H3
InChIKeyFDOOZDZDBUCZNS-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.83
Rot. Bonds5

About 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone

1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone (PubChem CID 177246197) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone.

Molecular Properties

Compound Name1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone
PubChem CID177246197
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone
SMILESCCCN(CC)c1ccc(C(C)=O)nc1C
InChIInChI=1S/C13H20N2O/c1-5-9-15(6-2)13-8-7-12(11(4)16)14-10(13)3/h7-8H,5-6,9H2,1-4H3
InChIKeyFDOOZDZDBUCZNS-UHFFFAOYSA-N
XLogP2.83
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone?
The IUPAC name of 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone (CID 177246197) is 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone.
What is the SMILES notation for 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone?
The canonical SMILES for 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone is CCCN(CC)c1ccc(C(C)=O)nc1C.
What is the InChIKey of 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone?
The InChIKey is FDOOZDZDBUCZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-5-9-15(6-2)13-8-7-12(11(4)16)14-10(13)3/h7-8H,5-6,9H2,1-4H3.
What are the key properties of 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone?
1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone has a molecular weight of 220.32 g/mol, XLogP of 2.83, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[ethyl(propyl)amino]-6-methyl-2-pyridinyl]ethanone is sourced from PubChem (CID 177246197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).