1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one

C13H18N4O — CID 62208668

IUPAC1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one
SMILESCCNc1c(Cn2ccccc2=O)c(C)nn1C
InChIInChI=1S/C13H18N4O/c1-4-14-13-11(10(2)15-16(13)3)9-17-8-6-5-7-12(17)18/h5-8,14H,4,9H2,1-3H3
InChIKeyCHFKEFAJNRQQIO-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.37
Rot. Bonds4

About 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one

1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one (PubChem CID 62208668) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one.

Molecular Properties

Compound Name1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one
PubChem CID62208668
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one
SMILESCCNc1c(Cn2ccccc2=O)c(C)nn1C
InChIInChI=1S/C13H18N4O/c1-4-14-13-11(10(2)15-16(13)3)9-17-8-6-5-7-12(17)18/h5-8,14H,4,9H2,1-3H3
InChIKeyCHFKEFAJNRQQIO-UHFFFAOYSA-N
XLogP1.37
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[[1,3-dimethyl-5-(methylamino)pyrazol-4-yl]methyl]pyridin-2-one
CID 62208487
[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methanol
CID 62194679
3-[[1,3-dimethyl-5-(methylamino)pyrazol-4-yl]methyl]-6-methylpyrimidin-4-one
CID 62193988
1-[2-[4-(hydroxymethyl)-3,5-dimethylpyrazol-1-yl]ethyl]pyridin-2-one
CID 82907789
1-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]pyridin-2-one
CID 116618483
N-ethyl-1,3-dimethyl-4-[(3-methylpyrrolidin-1-yl)methyl]pyrazol-5-amine
CID 55046124
4-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methylsulfanyl]phenol
CID 55044477
4-(2,6-difluorophenyl)-N-ethyl-1,3-dimethylpyrazol-5-amine
CID 140655069
N-ethyl-1,3-dimethyl-4-(propan-2-yloxymethyl)pyrazol-5-amine
CID 62194625
1-[(3-methylquinoxalin-2-yl)methyl]pyridin-2-one
CID 39967034
1-[[1,3-dimethyl-5-(propylamino)pyrazol-4-yl]methyl]pyrrolidine-2,5-dione
CID 55046145
1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]pyridin-2-one
CID 115687909

Frequently Asked Questions

What is the IUPAC name of 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one?
The IUPAC name of 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one (CID 62208668) is 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one.
What is the SMILES notation for 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one?
The canonical SMILES for 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one is CCNc1c(Cn2ccccc2=O)c(C)nn1C.
What is the InChIKey of 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one?
The InChIKey is CHFKEFAJNRQQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-4-14-13-11(10(2)15-16(13)3)9-17-8-6-5-7-12(17)18/h5-8,14H,4,9H2,1-3H3.
What are the key properties of 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one?
1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one has a molecular weight of 246.31 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(ethylamino)-1,3-dimethylpyrazol-4-yl]methyl]pyridin-2-one is sourced from PubChem (CID 62208668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).