1-ethyl-3-(ethylaminomethyl)pyridin-2-one

C10H16N2O — CID 82527243

IUPAC1-ethyl-3-(ethylaminomethyl)pyridin-2-one
SMILESCCNCc1cccn(CC)c1=O
InChIInChI=1S/C10H16N2O/c1-3-11-8-9-6-5-7-12(4-2)10(9)13/h5-7,11H,3-4,8H2,1-2H3
InChIKeyCZNDZJPSKAFDNG-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.98
Rot. Bonds4

About 1-ethyl-3-(ethylaminomethyl)pyridin-2-one

1-ethyl-3-(ethylaminomethyl)pyridin-2-one (PubChem CID 82527243) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-ethyl-3-(ethylaminomethyl)pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-3-(ethylaminomethyl)pyridin-2-one
PubChem CID82527243
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name1-ethyl-3-(ethylaminomethyl)pyridin-2-one
SMILESCCNCc1cccn(CC)c1=O
InChIInChI=1S/C10H16N2O/c1-3-11-8-9-6-5-7-12(4-2)10(9)13/h5-7,11H,3-4,8H2,1-2H3
InChIKeyCZNDZJPSKAFDNG-UHFFFAOYSA-N
XLogP0.98
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylaminomethyl)-1-(3-methoxypropyl)pyridin-2-one
CID 82526386
1-[(1-ethyl-2-oxo-3-pyridinyl)methyl]-2,3-dimethylguanidine;hydroiodide
CID 120605821
3-(1-ethyl-2-oxo-3-pyridinyl)propanoic acid
CID 82527174
3-(3-aminopropyl)-1-ethylpyridin-2-one
CID 105438966
1-[(1-ethyl-2-oxo-3-pyridinyl)methyl]-1,3-diazinane-2,4-dione
CID 174356600
3-[(2-methoxyethylamino)methyl]-1-pentylpyridin-2-one
CID 82526709
2-(ethylaminomethyl)phenol
CID 12995218
3-[2-(ethylaminomethyl)phenyl]-1H-imidazol-2-one
CID 103124791
1-(3,5-dimethylphenyl)-2-[(1-ethyl-2-oxo-3-pyridinyl)methyl]guanidine
CID 120605996
1-[2-(ethylaminomethyl)phenyl]pyrrole-2,5-dione
CID 61349411
N-[(1-ethyl-2-oxo-3-pyridinyl)methyl]-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide
CID 138035232
2-[(1-ethyl-2-oxo-3-pyridinyl)methyl]-1-(3-methylphenyl)guanidine
CID 120605998

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(ethylaminomethyl)pyridin-2-one?
The IUPAC name of 1-ethyl-3-(ethylaminomethyl)pyridin-2-one (CID 82527243) is 1-ethyl-3-(ethylaminomethyl)pyridin-2-one.
What is the SMILES notation for 1-ethyl-3-(ethylaminomethyl)pyridin-2-one?
The canonical SMILES for 1-ethyl-3-(ethylaminomethyl)pyridin-2-one is CCNCc1cccn(CC)c1=O.
What is the InChIKey of 1-ethyl-3-(ethylaminomethyl)pyridin-2-one?
The InChIKey is CZNDZJPSKAFDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-3-11-8-9-6-5-7-12(4-2)10(9)13/h5-7,11H,3-4,8H2,1-2H3.
What are the key properties of 1-ethyl-3-(ethylaminomethyl)pyridin-2-one?
1-ethyl-3-(ethylaminomethyl)pyridin-2-one has a molecular weight of 180.25 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(ethylaminomethyl)pyridin-2-one is sourced from PubChem (CID 82527243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).