5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide

C11H18N4O2 — CID 79466135

IUPAC5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide
SMILESCc1nn(C)c(OC2CCC(N)C2)c1C(N)=O
InChIInChI=1S/C11H18N4O2/c1-6-9(10(13)16)11(15(2)14-6)17-8-4-3-7(12)5-8/h7-8H,3-5,12H2,1-2H3,(H2,13,16)
InChIKeySPFLROWJLSKDDW-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.09
Rot. Bonds3

About 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide

5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide (PubChem CID 79466135) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide
PubChem CID79466135
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide
SMILESCc1nn(C)c(OC2CCC(N)C2)c1C(N)=O
InChIInChI=1S/C11H18N4O2/c1-6-9(10(13)16)11(15(2)14-6)17-8-4-3-7(12)5-8/h7-8H,3-5,12H2,1-2H3,(H2,13,16)
InChIKeySPFLROWJLSKDDW-UHFFFAOYSA-N
XLogP0.09
TPSA96.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide?
The IUPAC name of 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide (CID 79466135) is 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide?
The canonical SMILES for 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide is Cc1nn(C)c(OC2CCC(N)C2)c1C(N)=O.
What is the InChIKey of 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide?
The InChIKey is SPFLROWJLSKDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-6-9(10(13)16)11(15(2)14-6)17-8-4-3-7(12)5-8/h7-8H,3-5,12H2,1-2H3,(H2,13,16).
What are the key properties of 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide?
5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminocyclopentyl)oxy-1,3-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 79466135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).