2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide

C13H17N5O2 — CID 62815312

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
SMILESCN(Cc1cnn(C)c1)C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C13H17N5O2/c1-16(6-10-5-15-17(2)7-10)13(20)9-18-8-11(14)3-4-12(18)19/h3-5,7-8H,6,9,14H2,1-2H3
InChIKeyWHBNHGSEJUZZEK-UHFFFAOYSA-N
MW275.31 g/mol
LogP-0.18
Rot. Bonds4

About 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide (PubChem CID 62815312) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
PubChem CID62815312
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
SMILESCN(Cc1cnn(C)c1)C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C13H17N5O2/c1-16(6-10-5-15-17(2)7-10)13(20)9-18-8-11(14)3-4-12(18)19/h3-5,7-8H,6,9,14H2,1-2H3
InChIKeyWHBNHGSEJUZZEK-UHFFFAOYSA-N
XLogP-0.18
TPSA86.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide (CID 62815312) is 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide is CN(Cc1cnn(C)c1)C(=O)Cn1cc(N)ccc1=O.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
The InChIKey is WHBNHGSEJUZZEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-16(6-10-5-15-17(2)7-10)13(20)9-18-8-11(14)3-4-12(18)19/h3-5,7-8H,6,9,14H2,1-2H3.
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide has a molecular weight of 275.31 g/mol, XLogP of -0.18, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide is sourced from PubChem (CID 62815312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).