6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide

C15H18N4O2 — CID 128986477

IUPAC6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)N[C@H]2CCO[C@@H]2c2ccnn2C)n1
InChIInChI=1S/C15H18N4O2/c1-10-4-3-5-12(17-10)15(20)18-11-7-9-21-14(11)13-6-8-16-19(13)2/h3-6,8,11,14H,7,9H2,1-2H3,(H,18,20)/t11-,14-/m0/s1
InChIKeyLLZAZTBZGGYBPR-FZMZJTMJSA-N
MW286.33 g/mol
LogP1.38
Rot. Bonds3

About 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide

6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide (PubChem CID 128986477) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide
PubChem CID128986477
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)N[C@H]2CCO[C@@H]2c2ccnn2C)n1
InChIInChI=1S/C15H18N4O2/c1-10-4-3-5-12(17-10)15(20)18-11-7-9-21-14(11)13-6-8-16-19(13)2/h3-6,8,11,14H,7,9H2,1-2H3,(H,18,20)/t11-,14-/m0/s1
InChIKeyLLZAZTBZGGYBPR-FZMZJTMJSA-N
XLogP1.38
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide (CID 128986477) is 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide is Cc1cccc(C(=O)N[C@H]2CCO[C@@H]2c2ccnn2C)n1.
What is the InChIKey of 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide?
The InChIKey is LLZAZTBZGGYBPR-FZMZJTMJSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-10-4-3-5-12(17-10)15(20)18-11-7-9-21-14(11)13-6-8-16-19(13)2/h3-6,8,11,14H,7,9H2,1-2H3,(H,18,20)/t11-,14-/m0/s1.
What are the key properties of 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide?
6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide is sourced from PubChem (CID 128986477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).