2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine

C17H29N3O — CID 79911433

IUPAC2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine
SMILESCCN(CC)c1ccc(NC2CC(C)(C)OC2(C)C)cn1
InChIInChI=1S/C17H29N3O/c1-7-20(8-2)15-10-9-13(12-18-15)19-14-11-16(3,4)21-17(14,5)6/h9-10,12,14,19H,7-8,11H2,1-6H3
InChIKeyWGLSMYXQNQNYSG-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.69
Rot. Bonds5

About 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine

2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine (PubChem CID 79911433) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine
PubChem CID79911433
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine
SMILESCCN(CC)c1ccc(NC2CC(C)(C)OC2(C)C)cn1
InChIInChI=1S/C17H29N3O/c1-7-20(8-2)15-10-9-13(12-18-15)19-14-11-16(3,4)21-17(14,5)6/h9-10,12,14,19H,7-8,11H2,1-6H3
InChIKeyWGLSMYXQNQNYSG-UHFFFAOYSA-N
XLogP3.69
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine?
The IUPAC name of 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine (CID 79911433) is 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine?
The canonical SMILES for 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine is CCN(CC)c1ccc(NC2CC(C)(C)OC2(C)C)cn1.
What is the InChIKey of 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine?
The InChIKey is WGLSMYXQNQNYSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-7-20(8-2)15-10-9-13(12-18-15)19-14-11-16(3,4)21-17(14,5)6/h9-10,12,14,19H,7-8,11H2,1-6H3.
What are the key properties of 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine?
2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine has a molecular weight of 291.44 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-5-N-(2,2,5,5-tetramethyloxolan-3-yl)pyridine-2,5-diamine is sourced from PubChem (CID 79911433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).