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

C11H15N3O2 — CID 103865039

IUPACN-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide
SMILESO=C(NC1CCOC1C1CC1)c1cn[nH]c1
InChIInChI=1S/C11H15N3O2/c15-11(8-5-12-13-6-8)14-9-3-4-16-10(9)7-1-2-7/h5-7,9-10H,1-4H2,(H,12,13)(H,14,15)
InChIKeyOECKRIJEEJIVJW-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.71
Rot. Bonds3

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

N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide (PubChem CID 103865039) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide
PubChem CID103865039
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide
SMILESO=C(NC1CCOC1C1CC1)c1cn[nH]c1
InChIInChI=1S/C11H15N3O2/c15-11(8-5-12-13-6-8)14-9-3-4-16-10(9)7-1-2-7/h5-7,9-10H,1-4H2,(H,12,13)(H,14,15)
InChIKeyOECKRIJEEJIVJW-UHFFFAOYSA-N
XLogP0.71
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.71
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)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide (CID 103865039) is N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide is O=C(NC1CCOC1C1CC1)c1cn[nH]c1.
What is the InChIKey of N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is OECKRIJEEJIVJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-11(8-5-12-13-6-8)14-9-3-4-16-10(9)7-1-2-7/h5-7,9-10H,1-4H2,(H,12,13)(H,14,15).
What are the key properties of N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide?
N-(2-cyclopropyloxolan-3-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.71, 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)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 103865039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).