4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide

C10H14N6O — CID 55033895

IUPAC4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide
SMILESCc1n[nH]c(C)c1NC(=O)c1n[nH]c(C)c1N
InChIInChI=1S/C10H14N6O/c1-4-7(11)9(16-13-4)10(17)12-8-5(2)14-15-6(8)3/h11H2,1-3H3,(H,12,17)(H,13,16)(H,14,15)
InChIKeyATQGRMXTABSHGE-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.89
Rot. Bonds2

About 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide

4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide (PubChem CID 55033895) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide
PubChem CID55033895
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide
SMILESCc1n[nH]c(C)c1NC(=O)c1n[nH]c(C)c1N
InChIInChI=1S/C10H14N6O/c1-4-7(11)9(16-13-4)10(17)12-8-5(2)14-15-6(8)3/h11H2,1-3H3,(H,12,17)(H,13,16)(H,14,15)
InChIKeyATQGRMXTABSHGE-UHFFFAOYSA-N
XLogP0.89
TPSA112.48 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide (CID 55033895) is 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide is Cc1n[nH]c(C)c1NC(=O)c1n[nH]c(C)c1N.
What is the InChIKey of 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide?
The InChIKey is ATQGRMXTABSHGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-4-7(11)9(16-13-4)10(17)12-8-5(2)14-15-6(8)3/h11H2,1-3H3,(H,12,17)(H,13,16)(H,14,15).
What are the key properties of 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide?
4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide has a molecular weight of 234.26 g/mol, XLogP of 0.89, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 55033895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).