5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide

C11H18N4OS — CID 104589557

IUPAC5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide
SMILESCSC1CCCC1NC(=O)c1cnn(C)c1N
InChIInChI=1S/C11H18N4OS/c1-15-10(12)7(6-13-15)11(16)14-8-4-3-5-9(8)17-2/h6,8-9H,3-5,12H2,1-2H3,(H,14,16)
InChIKeyUVPWOSAMZUOLMV-UHFFFAOYSA-N
MW254.36 g/mol
LogP1.02
Rot. Bonds3

About 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide

5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide (PubChem CID 104589557) has the molecular formula C11H18N4OS and a molecular weight of 254.36 g/mol. Its IUPAC name is 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide
PubChem CID104589557
Molecular FormulaC11H18N4OS
Molecular Weight254.36 g/mol
Exact Mass254.12
IUPAC Name5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide
SMILESCSC1CCCC1NC(=O)c1cnn(C)c1N
InChIInChI=1S/C11H18N4OS/c1-15-10(12)7(6-13-15)11(16)14-8-4-3-5-9(8)17-2/h6,8-9H,3-5,12H2,1-2H3,(H,14,16)
InChIKeyUVPWOSAMZUOLMV-UHFFFAOYSA-N
XLogP1.02
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-(2,4-dimethylcyclohexyl)-1-methylpyrazole-4-carboxamide
CID 113288605
5-amino-N-(2,6-dimethylpiperidin-1-yl)-1-methylpyrazole-4-carboxamide
CID 83022591
5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide
CID 115330669
5-amino-1-methyl-N-(3-methylcyclobutyl)pyrazole-4-carboxamide
CID 104589762
5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide
CID 114549373
5-amino-N-(4-ethylcyclohexyl)-1-methylpyrazole-4-carboxamide
CID 115330542
5-amino-N-(1-cyclopentylpyrrolidin-3-yl)-1-methylpyrazole-4-carboxamide
CID 110485291
2-chloro-N-(2-methylsulfanylcyclohexyl)furan-3-carboxamide
CID 106812109
5-amino-N-(3-ethylsulfanylcyclopentyl)-1-methylpyrazole-4-carboxamide
CID 104589681
5-amino-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-1-methylpyrazole-4-carboxamide
CID 115330965
N-(2-aminocycloheptyl)-1,5-dimethylpyrazole-4-carboxamide
CID 63258060
5-amino-N-(2,5-dioxopyrrolidin-3-yl)-1-methylpyrazole-4-carboxamide
CID 110485263

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide (CID 104589557) is 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide is CSC1CCCC1NC(=O)c1cnn(C)c1N.
What is the InChIKey of 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide?
The InChIKey is UVPWOSAMZUOLMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4OS/c1-15-10(12)7(6-13-15)11(16)14-8-4-3-5-9(8)17-2/h6,8-9H,3-5,12H2,1-2H3,(H,14,16).
What are the key properties of 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide?
5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide has a molecular weight of 254.36 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-N-(2-methylsulfanylcyclopentyl)pyrazole-4-carboxamide is sourced from PubChem (CID 104589557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).