N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide

C12H17N3O2 — CID 113341333

IUPACN-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)NC1CCOC1C1CC1
InChIInChI=1S/C12H17N3O2/c1-7-9(6-13-15-7)12(16)14-10-4-5-17-11(10)8-2-3-8/h6,8,10-11H,2-5H2,1H3,(H,13,15)(H,14,16)
InChIKeyOLFWTNUZILZJIF-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.02
Rot. Bonds3

About N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide

N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide (PubChem CID 113341333) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide
PubChem CID113341333
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)NC1CCOC1C1CC1
InChIInChI=1S/C12H17N3O2/c1-7-9(6-13-15-7)12(16)14-10-4-5-17-11(10)8-2-3-8/h6,8,10-11H,2-5H2,1H3,(H,13,15)(H,14,16)
InChIKeyOLFWTNUZILZJIF-UHFFFAOYSA-N
XLogP1.02
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide (CID 113341333) is N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide is Cc1[nH]ncc1C(=O)NC1CCOC1C1CC1.
What is the InChIKey of N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide?
The InChIKey is OLFWTNUZILZJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-7-9(6-13-15-7)12(16)14-10-4-5-17-11(10)8-2-3-8/h6,8,10-11H,2-5H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide?
N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyloxolan-3-yl)-5-methyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 113341333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).