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

C11H18N4O — CID 114549373

IUPAC5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide
SMILESCC1CCC(NC(=O)c2cnn(C)c2N)C1
InChIInChI=1S/C11H18N4O/c1-7-3-4-8(5-7)14-11(16)9-6-13-15(2)10(9)12/h6-8H,3-5,12H2,1-2H3,(H,14,16)
InChIKeyIEOGSXQFYBDRLW-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.92
Rot. Bonds2

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

5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide (PubChem CID 114549373) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide
PubChem CID114549373
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide
SMILESCC1CCC(NC(=O)c2cnn(C)c2N)C1
InChIInChI=1S/C11H18N4O/c1-7-3-4-8(5-7)14-11(16)9-6-13-15(2)10(9)12/h6-8H,3-5,12H2,1-2H3,(H,14,16)
InChIKeyIEOGSXQFYBDRLW-UHFFFAOYSA-N
XLogP0.92
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.92
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-methylcyclopentyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide (CID 114549373) is 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide is CC1CCC(NC(=O)c2cnn(C)c2N)C1.
What is the InChIKey of 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide?
The InChIKey is IEOGSXQFYBDRLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-7-3-4-8(5-7)14-11(16)9-6-13-15(2)10(9)12/h6-8H,3-5,12H2,1-2H3,(H,14,16).
What are the key properties of 5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide?
5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.92, 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-methylcyclopentyl)pyrazole-4-carboxamide is sourced from PubChem (CID 114549373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).