(2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide

C13H18N6O2 — CID 128969887

IUPAC(2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide
SMILESCCc1nc(NC(=O)[C@@H]2CCO[C@H]2c2nccn2C)n[nH]1
InChIInChI=1S/C13H18N6O2/c1-3-9-15-13(18-17-9)16-12(20)8-4-7-21-10(8)11-14-5-6-19(11)2/h5-6,8,10H,3-4,7H2,1-2H3,(H2,15,16,17,18,20)/t8-,10-/m1/s1
InChIKeyJHIXAWDBQISYOW-PSASIEDQSA-N
MW290.33 g/mol
LogP0.82
Rot. Bonds4

About (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide

(2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide (PubChem CID 128969887) has the molecular formula C13H18N6O2 and a molecular weight of 290.33 g/mol. Its IUPAC name is (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide
PubChem CID128969887
Molecular FormulaC13H18N6O2
Molecular Weight290.33 g/mol
Exact Mass290.15
IUPAC Name(2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide
SMILESCCc1nc(NC(=O)[C@@H]2CCO[C@H]2c2nccn2C)n[nH]1
InChIInChI=1S/C13H18N6O2/c1-3-9-15-13(18-17-9)16-12(20)8-4-7-21-10(8)11-14-5-6-19(11)2/h5-6,8,10H,3-4,7H2,1-2H3,(H2,15,16,17,18,20)/t8-,10-/m1/s1
InChIKeyJHIXAWDBQISYOW-PSASIEDQSA-N
XLogP0.82
TPSA97.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-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

Related Compounds

(2R,3R)-2-(1-ethylimidazol-2-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]oxolane-3-carboxamide
CID 128977935
5-[(2R,3R)-3-(imidazol-1-ylmethyl)oxolan-2-yl]-N-(2,2,2-trifluoroethyl)-1H-1,2,4-triazol-3-amine
CID 167847471
[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-[3-(1,2,4-triazol-1-ylmethyl)piperidin-1-yl]methanone
CID 128331528
(2R,3R)-2-(1-methylimidazol-2-yl)-N-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)methyl]oxolane-3-carboxamide
CID 128333132
[(2R,3R)-2-(1-ethylimidazol-2-yl)oxolan-3-yl]-[4-(5-ethyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
CID 128341018
(2R,3R)-2-(1-ethylimidazol-2-yl)-N-(4-ethyl-1,2,4-triazol-3-yl)oxolane-3-carboxamide
CID 128987502
(2R,3R)-N-(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)-2-(1-ethylimidazol-2-yl)oxolane-3-carboxamide
CID 128987509
(2R,3R)-N-(4-cyclopropyl-1,2,4-triazol-3-yl)-2-(1-ethylimidazol-2-yl)oxolane-3-carboxamide
CID 128987520
N-methyl-2-(2-methylimidazol-1-yl)-N-[[(2S,3S)-3-(5-methyl-1H-1,2,4-triazol-3-yl)oxolan-2-yl]methyl]acetamide
CID 132401248
N-methyl-2-(2-methylimidazol-1-yl)-N-[[(2S,3S)-3-(1H-1,2,4-triazol-5-yl)oxolan-2-yl]methyl]acetamide
CID 132401403
N-[[(2R,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methyl]-1H-1,2,4-triazole-5-carboxamide
CID 137870139
3-N,3-N-dimethyl-5-N-[[(2R,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]methyl]-1H-1,2,4-triazole-3,5-diamine
CID 137879508

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
The IUPAC name of (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide (CID 128969887) is (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide is CCc1nc(NC(=O)[C@@H]2CCO[C@H]2c2nccn2C)n[nH]1.
What is the InChIKey of (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
The InChIKey is JHIXAWDBQISYOW-PSASIEDQSA-N. The full InChI is InChI=1S/C13H18N6O2/c1-3-9-15-13(18-17-9)16-12(20)8-4-7-21-10(8)11-14-5-6-19(11)2/h5-6,8,10H,3-4,7H2,1-2H3,(H2,15,16,17,18,20)/t8-,10-/m1/s1.
What are the key properties of (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide?
(2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide has a molecular weight of 290.33 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-(5-ethyl-1H-1,2,4-triazol-3-yl)-2-(1-methylimidazol-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 128969887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).