(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide

C13H17N5O2 — CID 128978576

IUPAC(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1cn[nH]c1
InChIInChI=1S/C13H17N5O2/c1-2-18-5-4-14-12(18)11-10(3-6-20-11)13(19)17-9-7-15-16-8-9/h4-5,7-8,10-11H,2-3,6H2,1H3,(H,15,16)(H,17,19)/t10-,11-/m1/s1
InChIKeyOYYKBEOKRBQPIL-GHMZBOCLSA-N
MW275.31 g/mol
LogP1.34
Rot. Bonds4

About (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide

(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide (PubChem CID 128978576) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide
PubChem CID128978576
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide
SMILESCCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1cn[nH]c1
InChIInChI=1S/C13H17N5O2/c1-2-18-5-4-14-12(18)11-10(3-6-20-11)13(19)17-9-7-15-16-8-9/h4-5,7-8,10-11H,2-3,6H2,1H3,(H,15,16)(H,17,19)/t10-,11-/m1/s1
InChIKeyOYYKBEOKRBQPIL-GHMZBOCLSA-N
XLogP1.34
TPSA84.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-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 (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide?
The IUPAC name of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide (CID 128978576) is (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide is CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1cn[nH]c1.
What is the InChIKey of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide?
The InChIKey is OYYKBEOKRBQPIL-GHMZBOCLSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-2-18-5-4-14-12(18)11-10(3-6-20-11)13(19)17-9-7-15-16-8-9/h4-5,7-8,10-11H,2-3,6H2,1H3,(H,15,16)(H,17,19)/t10-,11-/m1/s1.
What are the key properties of (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide?
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide has a molecular weight of 275.31 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-(1-ethylimidazol-2-yl)-N-(1H-pyrazol-4-yl)oxolane-3-carboxamide is sourced from PubChem (CID 128978576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).