N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide

C16H25N3O2 — CID 133439056

IUPACN-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(NC2CC(C)(C)OC2(C)C)nc1
InChIInChI=1S/C16H25N3O2/c1-6-17-14(20)11-7-8-13(18-10-11)19-12-9-15(2,3)21-16(12,4)5/h7-8,10,12H,6,9H2,1-5H3,(H,17,20)(H,18,19)
InChIKeyBCXQBKVBIYFDES-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.59
Rot. Bonds4

About N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide

N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide (PubChem CID 133439056) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide
PubChem CID133439056
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC NameN-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(NC2CC(C)(C)OC2(C)C)nc1
InChIInChI=1S/C16H25N3O2/c1-6-17-14(20)11-7-8-13(18-10-11)19-12-9-15(2,3)21-16(12,4)5/h7-8,10,12H,6,9H2,1-5H3,(H,17,20)(H,18,19)
InChIKeyBCXQBKVBIYFDES-UHFFFAOYSA-N
XLogP2.59
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide?
The IUPAC name of N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide (CID 133439056) is N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide is CCNC(=O)c1ccc(NC2CC(C)(C)OC2(C)C)nc1.
What is the InChIKey of N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide?
The InChIKey is BCXQBKVBIYFDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-6-17-14(20)11-7-8-13(18-10-11)19-12-9-15(2,3)21-16(12,4)5/h7-8,10,12H,6,9H2,1-5H3,(H,17,20)(H,18,19).
What are the key properties of N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide?
N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[(2,2,5,5-tetramethyloxolan-3-yl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 133439056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).