1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one

C11H15N5O — CID 62755967

IUPAC1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one
SMILESCCn1cc(NCc2cn(C)nn2)ccc1=O
InChIInChI=1S/C11H15N5O/c1-3-16-8-9(4-5-11(16)17)12-6-10-7-15(2)14-13-10/h4-5,7-8,12H,3,6H2,1-2H3
InChIKeyWNKICIDJOORCKC-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.61
Rot. Bonds4

About 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one

1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one (PubChem CID 62755967) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one
PubChem CID62755967
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one
SMILESCCn1cc(NCc2cn(C)nn2)ccc1=O
InChIInChI=1S/C11H15N5O/c1-3-16-8-9(4-5-11(16)17)12-6-10-7-15(2)14-13-10/h4-5,7-8,12H,3,6H2,1-2H3
InChIKeyWNKICIDJOORCKC-UHFFFAOYSA-N
XLogP0.61
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(1-tert-butyltriazol-4-yl)methylamino]-1-ethylpyridin-2-one
CID 103398925
N-[4-[(1-methyltriazol-4-yl)methylamino]phenyl]ethanesulfonamide
CID 62755629
1-ethyl-5-[(2-methyl-1,3-thiazol-4-yl)methylamino]pyridin-2-one
CID 54863936
1-ethyl-5-[(3-ethyl-1-methylpyrazol-4-yl)methylamino]pyridin-2-one
CID 112668948
1-ethyl-5-[(2-methylpyrazol-3-yl)methylamino]pyridin-2-one
CID 54864112
1-ethyl-5-[(4-ethylphenyl)methylamino]pyridin-2-one
CID 54864000
4-N,4-N-diethyl-1-N-[(1-methyltriazol-4-yl)methyl]benzene-1,4-diamine
CID 62756674
N-ethyl-4-[(1-methyltriazol-4-yl)methylamino]benzamide
CID 62757413
5-[(1,5-dimethylpyrazol-4-yl)methylamino]-1-ethylpyridin-2-one
CID 79579074
2-[4-[(1-methyltriazol-4-yl)methylamino]phenyl]acetamide
CID 55113606
1-ethyl-5-[(2-propylpyrazol-3-yl)methylamino]pyridin-2-one
CID 114555517
5-[(2,6-difluorophenyl)methylamino]-1-ethylpyridin-2-one
CID 54864001

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one?
The IUPAC name of 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one (CID 62755967) is 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one.
What is the SMILES notation for 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one?
The canonical SMILES for 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one is CCn1cc(NCc2cn(C)nn2)ccc1=O.
What is the InChIKey of 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one?
The InChIKey is WNKICIDJOORCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-3-16-8-9(4-5-11(16)17)12-6-10-7-15(2)14-13-10/h4-5,7-8,12H,3,6H2,1-2H3.
What are the key properties of 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one?
1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one has a molecular weight of 233.28 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-[(1-methyltriazol-4-yl)methylamino]pyridin-2-one is sourced from PubChem (CID 62755967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).