6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine

C14H19N3OS — CID 62842553

IUPAC6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
SMILESCCCOc1nc(NC(C)c2ccsc2)ccc1N
InChIInChI=1S/C14H19N3OS/c1-3-7-18-14-12(15)4-5-13(17-14)16-10(2)11-6-8-19-9-11/h4-6,8-10H,3,7,15H2,1-2H3,(H,16,17)
InChIKeyNKSKHXLKUCDOAZ-UHFFFAOYSA-N
MW277.39 g/mol
LogP3.69
Rot. Bonds6

About 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine

6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine (PubChem CID 62842553) has the molecular formula C14H19N3OS and a molecular weight of 277.39 g/mol. Its IUPAC name is 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
PubChem CID62842553
Molecular FormulaC14H19N3OS
Molecular Weight277.39 g/mol
Exact Mass277.12
IUPAC Name6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
SMILESCCCOc1nc(NC(C)c2ccsc2)ccc1N
InChIInChI=1S/C14H19N3OS/c1-3-7-18-14-12(15)4-5-13(17-14)16-10(2)11-6-8-19-9-11/h4-6,8-10H,3,7,15H2,1-2H3,(H,16,17)
InChIKeyNKSKHXLKUCDOAZ-UHFFFAOYSA-N
XLogP3.69
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
CID 55121867
2-[(5-amino-6-propoxy-2-pyridinyl)amino]-1-thiophen-3-ylethanol
CID 106434587
2-N-propan-2-yl-6-propoxypyridine-2,5-diamine
CID 43260874
6-propoxy-2-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2,5-diamine
CID 106217168
6-propoxy-2-N-thiophen-3-ylpyridine-2,5-diamine
CID 66351232
2-N-(2-methylpentan-3-yl)-6-propoxypyridine-2,5-diamine
CID 54954505
6-propoxy-2-N-(2-thiophen-3-ylethyl)pyridine-2,5-diamine
CID 61474843
2-N-heptan-2-yl-6-propoxypyridine-2,5-diamine
CID 63402628
2-[(5-amino-6-propoxy-2-pyridinyl)amino]propanamide
CID 43545441
2-N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-propoxypyridine-2,5-diamine
CID 61476370
5-methyl-2-N-(1-thiophen-3-ylethyl)pyridine-2,4-diamine
CID 83265635
6-(2-methylpropoxy)-2-N-thiophen-3-ylpyridine-2,5-diamine
CID 66351449

Frequently Asked Questions

What is the IUPAC name of 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
The IUPAC name of 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine (CID 62842553) is 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine.
What is the SMILES notation for 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
The canonical SMILES for 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine is CCCOc1nc(NC(C)c2ccsc2)ccc1N.
What is the InChIKey of 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
The InChIKey is NKSKHXLKUCDOAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3OS/c1-3-7-18-14-12(15)4-5-13(17-14)16-10(2)11-6-8-19-9-11/h4-6,8-10H,3,7,15H2,1-2H3,(H,16,17).
What are the key properties of 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine has a molecular weight of 277.39 g/mol, XLogP of 3.69, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine is sourced from PubChem (CID 62842553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).