5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide

C10H16N4O — CID 104589762

IUPAC5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide
SMILESCC1CC(NC(=O)c2cnn(C)c2N)C1
InChIInChI=1S/C10H16N4O/c1-6-3-7(4-6)13-10(15)8-5-12-14(2)9(8)11/h5-7H,3-4,11H2,1-2H3,(H,13,15)
InChIKeyVAEMZSWSRJJREQ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.53
Rot. Bonds2

About 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide

5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide (PubChem CID 104589762) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide
PubChem CID104589762
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide
SMILESCC1CC(NC(=O)c2cnn(C)c2N)C1
InChIInChI=1S/C10H16N4O/c1-6-3-7(4-6)13-10(15)8-5-12-14(2)9(8)11/h5-7H,3-4,11H2,1-2H3,(H,13,15)
InChIKeyVAEMZSWSRJJREQ-UHFFFAOYSA-N
XLogP0.53
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide (CID 104589762) is 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide is CC1CC(NC(=O)c2cnn(C)c2N)C1.
What is the InChIKey of 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide?
The InChIKey is VAEMZSWSRJJREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-3-7(4-6)13-10(15)8-5-12-14(2)9(8)11/h5-7H,3-4,11H2,1-2H3,(H,13,15).
What are the key properties of 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide?
5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide is sourced from PubChem (CID 104589762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).