2-(3-aminopyrazol-1-yl)-N-methylacetamide

C6H10N4O — CID 60783095

IUPAC2-(3-aminopyrazol-1-yl)-N-methylacetamide
SMILESCNC(=O)Cn1ccc(N)n1
InChIInChI=1S/C6H10N4O/c1-8-6(11)4-10-3-2-5(7)9-10/h2-3H,4H2,1H3,(H2,7,9)(H,8,11)
InChIKeyWZUWPRXQCYQBDW-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.79
Rot. Bonds2

About 2-(3-aminopyrazol-1-yl)-N-methylacetamide

2-(3-aminopyrazol-1-yl)-N-methylacetamide (PubChem CID 60783095) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-methylacetamide
PubChem CID60783095
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name2-(3-aminopyrazol-1-yl)-N-methylacetamide
SMILESCNC(=O)Cn1ccc(N)n1
InChIInChI=1S/C6H10N4O/c1-8-6(11)4-10-3-2-5(7)9-10/h2-3H,4H2,1H3,(H2,7,9)(H,8,11)
InChIKeyWZUWPRXQCYQBDW-UHFFFAOYSA-N
XLogP-0.79
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-methylacetamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-methylacetamide (CID 60783095) is 2-(3-aminopyrazol-1-yl)-N-methylacetamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-methylacetamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-methylacetamide is CNC(=O)Cn1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-methylacetamide?
The InChIKey is WZUWPRXQCYQBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-8-6(11)4-10-3-2-5(7)9-10/h2-3H,4H2,1H3,(H2,7,9)(H,8,11).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-methylacetamide?
2-(3-aminopyrazol-1-yl)-N-methylacetamide has a molecular weight of 154.17 g/mol, XLogP of -0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-methylacetamide is sourced from PubChem (CID 60783095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).