(2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide

C23H26N4O3 — CID 128973917

IUPAC(2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide
SMILESCc1cc(NC(=O)[C@H]2CCO[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c(=O)n(C)c1
InChIInChI=1S/C23H26N4O3/c1-14-12-19(23(29)26(4)13-14)24-22(28)18-10-11-30-21(18)20-15(2)25-27(16(20)3)17-8-6-5-7-9-17/h5-9,12-13,18,21H,10-11H2,1-4H3,(H,24,28)/t18-,21-/m0/s1
InChIKeyXYQGYEDTGKHUSD-RXVVDRJESA-N
MW406.49 g/mol
LogP3.21
Rot. Bonds4

About (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide

(2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide (PubChem CID 128973917) has the molecular formula C23H26N4O3 and a molecular weight of 406.49 g/mol. Its IUPAC name is (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide
PubChem CID128973917
Molecular FormulaC23H26N4O3
Molecular Weight406.49 g/mol
Exact Mass406.20
IUPAC Name(2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide
SMILESCc1cc(NC(=O)[C@H]2CCO[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c(=O)n(C)c1
InChIInChI=1S/C23H26N4O3/c1-14-12-19(23(29)26(4)13-14)24-22(28)18-10-11-30-21(18)20-15(2)25-27(16(20)3)17-8-6-5-7-9-17/h5-9,12-13,18,21H,10-11H2,1-4H3,(H,24,28)/t18-,21-/m0/s1
InChIKeyXYQGYEDTGKHUSD-RXVVDRJESA-N
XLogP3.21
TPSA78.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.49
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-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

Related Compounds

(2S,3S)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[(1S)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]oxolane-3-carboxamide
CID 129479141
(2S,3S)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[3-(methoxymethyl)phenyl]oxolane-3-carboxamide
CID 128966194
(2S,3S)-N-(2,6-dimethyl-3-pyridinyl)-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 128972023
(2S,3S)-N-(3-methyl-4-pyridinyl)-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 128995869
(2S,3S)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 128973107
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxane-4-carboxamide
CID 51279535
(2S,3S)-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxylic acid
CID 86812166
(2S,3S)-N-(1-methyl-6-oxo-3-pyridinyl)-2-(1-phenylpyrazol-4-yl)oxolane-3-carboxamide
CID 128966167
1-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonyl-N-(2-methoxy-5-methylphenyl)piperidine-4-carboxamide
CID 53076020
(2S,3S)-N-[(2R)-2-(furan-2-yl)-2-hydroxyethyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 129325500
(2S,3S)-N-(4-methyl-1,3-thiazol-2-yl)-2-(1-phenylpyrazol-4-yl)oxolane-3-carboxamide
CID 128967401
(2S,3S)-N-[(1R)-1-pyridin-3-ylethyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 129327246

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide?
The IUPAC name of (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide (CID 128973917) is (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide.
What is the SMILES notation for (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide?
The canonical SMILES for (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide is Cc1cc(NC(=O)[C@H]2CCO[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c(=O)n(C)c1.
What is the InChIKey of (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide?
The InChIKey is XYQGYEDTGKHUSD-RXVVDRJESA-N. The full InChI is InChI=1S/C23H26N4O3/c1-14-12-19(23(29)26(4)13-14)24-22(28)18-10-11-30-21(18)20-15(2)25-27(16(20)3)17-8-6-5-7-9-17/h5-9,12-13,18,21H,10-11H2,1-4H3,(H,24,28)/t18-,21-/m0/s1.
What are the key properties of (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide?
(2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide has a molecular weight of 406.49 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-N-(1,5-dimethyl-2-oxo-3-pyridinyl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxolane-3-carboxamide is sourced from PubChem (CID 128973917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).