2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide

C10H12N2O3 — CID 124585246

IUPAC2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide
SMILESNC(=O)c1cccnc1O[C@H]1CCOC1
InChIInChI=1S/C10H12N2O3/c11-9(13)8-2-1-4-12-10(8)15-7-3-5-14-6-7/h1-2,4,7H,3,5-6H2,(H2,11,13)/t7-/m0/s1
InChIKeyLDLJIVMFBGBEKH-ZETCQYMHSA-N
MW208.22 g/mol
LogP0.35
Rot. Bonds3

About 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide

2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide (PubChem CID 124585246) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide
PubChem CID124585246
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide
SMILESNC(=O)c1cccnc1O[C@H]1CCOC1
InChIInChI=1S/C10H12N2O3/c11-9(13)8-2-1-4-12-10(8)15-7-3-5-14-6-7/h1-2,4,7H,3,5-6H2,(H2,11,13)/t7-/m0/s1
InChIKeyLDLJIVMFBGBEKH-ZETCQYMHSA-N
XLogP0.35
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide?
The IUPAC name of 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide (CID 124585246) is 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide?
The canonical SMILES for 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide is NC(=O)c1cccnc1O[C@H]1CCOC1.
What is the InChIKey of 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide?
The InChIKey is LDLJIVMFBGBEKH-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H12N2O3/c11-9(13)8-2-1-4-12-10(8)15-7-3-5-14-6-7/h1-2,4,7H,3,5-6H2,(H2,11,13)/t7-/m0/s1.
What are the key properties of 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide?
2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide has a molecular weight of 208.22 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-oxolan-3-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 124585246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).