(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide

C15H20N4O2S — CID 128995898

IUPAC(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide
SMILESCc1cnc(CNC(=O)[C@H]2CCO[C@@H]2c2cnn(C)c2C)s1
InChIInChI=1S/C15H20N4O2S/c1-9-6-16-13(22-9)8-17-15(20)11-4-5-21-14(11)12-7-18-19(3)10(12)2/h6-7,11,14H,4-5,8H2,1-3H3,(H,17,20)/t11-,14-/m0/s1
InChIKeyUGQARJTWDCTJJF-FZMZJTMJSA-N
MW320.42 g/mol
LogP1.89
Rot. Bonds4

About (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide

(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide (PubChem CID 128995898) has the molecular formula C15H20N4O2S and a molecular weight of 320.42 g/mol. Its IUPAC name is (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide
PubChem CID128995898
Molecular FormulaC15H20N4O2S
Molecular Weight320.42 g/mol
Exact Mass320.13
IUPAC Name(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide
SMILESCc1cnc(CNC(=O)[C@H]2CCO[C@@H]2c2cnn(C)c2C)s1
InChIInChI=1S/C15H20N4O2S/c1-9-6-16-13(22-9)8-17-15(20)11-4-5-21-14(11)12-7-18-19(3)10(12)2/h6-7,11,14H,4-5,8H2,1-3H3,(H,17,20)/t11-,14-/m0/s1
InChIKeyUGQARJTWDCTJJF-FZMZJTMJSA-N
XLogP1.89
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]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)-N-[(5-chloro-1,3-benzothiazol-2-yl)methyl]-2-(1,5-dimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 128998179
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-(5-methyl-1H-pyrazol-3-yl)oxolane-3-carboxamide
CID 128973434
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(1R)-1-thiophen-2-ylethyl]oxolane-3-carboxamide
CID 129473071
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]oxolane-3-carboxamide
CID 128970496
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[[(2S)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]oxolane-3-carboxamide
CID 129473378
(2S,3S)-N-(5-cyano-2-pyridinyl)-2-(1,5-dimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 129003975
(2S,3S)-N-[2-(2-chloro-6-fluorophenyl)-2-hydroxyethyl]-2-(1,5-dimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 128966683
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]oxolane-3-carboxamide
CID 129472390
(2S,3S)-N-(6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-yl)-2-(1,5-dimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 128966483
(2R,3S)-1-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-6-oxo-2-phenylpiperidine-3-carboxamide
CID 124607174
(2R,3R)-2-(1-propan-2-ylpyrazol-4-yl)-N-(1,3-thiazol-2-ylmethyl)oxolane-3-carboxamide
CID 166324188
(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide
CID 128966406

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide?
The IUPAC name of (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide (CID 128995898) is (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide.
What is the SMILES notation for (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide?
The canonical SMILES for (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide is Cc1cnc(CNC(=O)[C@H]2CCO[C@@H]2c2cnn(C)c2C)s1.
What is the InChIKey of (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide?
The InChIKey is UGQARJTWDCTJJF-FZMZJTMJSA-N. The full InChI is InChI=1S/C15H20N4O2S/c1-9-6-16-13(22-9)8-17-15(20)11-4-5-21-14(11)12-7-18-19(3)10(12)2/h6-7,11,14H,4-5,8H2,1-3H3,(H,17,20)/t11-,14-/m0/s1.
What are the key properties of (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide?
(2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide has a molecular weight of 320.42 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxolane-3-carboxamide is sourced from PubChem (CID 128995898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).