N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide

C9H13N3O2 — CID 60920354

IUPACN-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESO=C(NCC1CCOC1)c1cn[nH]c1
InChIInChI=1S/C9H13N3O2/c13-9(8-4-11-12-5-8)10-3-7-1-2-14-6-7/h4-5,7H,1-3,6H2,(H,10,13)(H,11,12)
InChIKeyLSOWBVHIAMZAFT-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.18
Rot. Bonds3

About N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide

N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide (PubChem CID 60920354) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide
PubChem CID60920354
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC NameN-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESO=C(NCC1CCOC1)c1cn[nH]c1
InChIInChI=1S/C9H13N3O2/c13-9(8-4-11-12-5-8)10-3-7-1-2-14-6-7/h4-5,7H,1-3,6H2,(H,10,13)(H,11,12)
InChIKeyLSOWBVHIAMZAFT-UHFFFAOYSA-N
XLogP0.18
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(oxolan-3-ylmethyl)-1H-pyrazole-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 N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide (CID 60920354) is N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide is O=C(NCC1CCOC1)c1cn[nH]c1.
What is the InChIKey of N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide?
The InChIKey is LSOWBVHIAMZAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c13-9(8-4-11-12-5-8)10-3-7-1-2-14-6-7/h4-5,7H,1-3,6H2,(H,10,13)(H,11,12).
What are the key properties of N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide?
N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide has a molecular weight of 195.22 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-ylmethyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 60920354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).