(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide

C20H25N3O2 — CID 129324298

IUPAC(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide
SMILESC[C@H](NC(=O)[C@H]1CCO[C@@H]1c1ccnn1Cc1ccccc1)C1CC1
InChIInChI=1S/C20H25N3O2/c1-14(16-7-8-16)22-20(24)17-10-12-25-19(17)18-9-11-21-23(18)13-15-5-3-2-4-6-15/h2-6,9,11,14,16-17,19H,7-8,10,12-13H2,1H3,(H,22,24)/t14-,17-,19-/m0/s1
InChIKeyLEGHZJOMKCULSE-FNHZYXHNSA-N
MW339.44 g/mol
LogP2.92
Rot. Bonds6

About (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide

(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide (PubChem CID 129324298) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide
PubChem CID129324298
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide
SMILESC[C@H](NC(=O)[C@H]1CCO[C@@H]1c1ccnn1Cc1ccccc1)C1CC1
InChIInChI=1S/C20H25N3O2/c1-14(16-7-8-16)22-20(24)17-10-12-25-19(17)18-9-11-21-23(18)13-15-5-3-2-4-6-15/h2-6,9,11,14,16-17,19H,7-8,10,12-13H2,1H3,(H,22,24)/t14-,17-,19-/m0/s1
InChIKeyLEGHZJOMKCULSE-FNHZYXHNSA-N
XLogP2.92
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]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

(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1R)-1-cyclopropylethyl]oxolane-3-carboxamide
CID 129324299
(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(2S)-3-methylbutan-2-yl]oxolane-3-carboxamide
CID 129350090
(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(4-hydroxyphenyl)methyl]-N-methyloxolane-3-carboxamide
CID 128971293
(2R,3R)-N-[(3R)-2,3-dihydro-1-benzofuran-3-yl]-2-(2-ethylpyrazol-3-yl)oxolane-3-carboxamide
CID 129342115
(2R,3R)-N-(1H-benzimidazol-2-yl)-2-(2-ethylpyrazol-3-yl)oxolane-3-carboxamide
CID 129001507
2-benzyl-N-(1-cyclopropylethyl)morpholine-4-carboxamide
CID 75445413
N-(1-chloro-3-phenylpropan-2-yl)-2-methyloxolane-3-carboxamide
CID 114300283
1-benzyl-N-[2-(1-cyclopropylethyl)pyrazol-3-yl]-6-oxopyridazine-3-carboxamide
CID 112761495
N-[(1S)-1-cyclopropylethyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 52528125
[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxoethyl] 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate
CID 8845020
(2S,3S)-2-(2-propan-2-ylpyrazol-3-yl)-N-[(1S)-1-(3-sulfamoylphenyl)ethyl]oxolane-3-carboxamide
CID 129325296
N-[(1R)-1-cyclopropylethyl]-2,2-diphenylacetamide
CID 8855432

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide?
The IUPAC name of (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide (CID 129324298) is (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide.
What is the SMILES notation for (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide?
The canonical SMILES for (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide is C[C@H](NC(=O)[C@H]1CCO[C@@H]1c1ccnn1Cc1ccccc1)C1CC1.
What is the InChIKey of (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide?
The InChIKey is LEGHZJOMKCULSE-FNHZYXHNSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-14(16-7-8-16)22-20(24)17-10-12-25-19(17)18-9-11-21-23(18)13-15-5-3-2-4-6-15/h2-6,9,11,14,16-17,19H,7-8,10,12-13H2,1H3,(H,22,24)/t14-,17-,19-/m0/s1.
What are the key properties of (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide?
(2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2-(2-benzylpyrazol-3-yl)-N-[(1S)-1-cyclopropylethyl]oxolane-3-carboxamide is sourced from PubChem (CID 129324298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).