N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide

C11H14N2O3 — CID 75504581

IUPACN-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
SMILESCNC(=O)c1ccnc(OC2CCOC2)c1
InChIInChI=1S/C11H14N2O3/c1-12-11(14)8-2-4-13-10(6-8)16-9-3-5-15-7-9/h2,4,6,9H,3,5,7H2,1H3,(H,12,14)
InChIKeyLEVMRDMDSKCCGU-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.61
Rot. Bonds3

About N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide

N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide (PubChem CID 75504581) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
PubChem CID75504581
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC NameN-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
SMILESCNC(=O)c1ccnc(OC2CCOC2)c1
InChIInChI=1S/C11H14N2O3/c1-12-11(14)8-2-4-13-10(6-8)16-9-3-5-15-7-9/h2,4,6,9H,3,5,7H2,1H3,(H,12,14)
InChIKeyLEVMRDMDSKCCGU-UHFFFAOYSA-N
XLogP0.61
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
The IUPAC name of N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide (CID 75504581) is N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
The canonical SMILES for N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide is CNC(=O)c1ccnc(OC2CCOC2)c1.
What is the InChIKey of N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
The InChIKey is LEVMRDMDSKCCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-12-11(14)8-2-4-13-10(6-8)16-9-3-5-15-7-9/h2,4,6,9H,3,5,7H2,1H3,(H,12,14).
What are the key properties of N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide has a molecular weight of 222.24 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide is sourced from PubChem (CID 75504581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).