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

C12H15N3OS — CID 55121867

IUPAC6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
SMILESCOc1nc(NC(C)c2ccsc2)ccc1N
InChIInChI=1S/C12H15N3OS/c1-8(9-5-6-17-7-9)14-11-4-3-10(13)12(15-11)16-2/h3-8H,13H2,1-2H3,(H,14,15)
InChIKeyHWQLINPHGYPQDU-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.91
Rot. Bonds4

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

6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine (PubChem CID 55121867) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
PubChem CID55121867
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
SMILESCOc1nc(NC(C)c2ccsc2)ccc1N
InChIInChI=1S/C12H15N3OS/c1-8(9-5-6-17-7-9)14-11-4-3-10(13)12(15-11)16-2/h3-8H,13H2,1-2H3,(H,14,15)
InChIKeyHWQLINPHGYPQDU-UHFFFAOYSA-N
XLogP2.91
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-propoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine
CID 62842553
2-N-[1-(furan-2-yl)ethyl]-6-methoxypyridine-2,5-diamine
CID 43535632
5-methyl-2-N-(1-thiophen-3-ylethyl)pyridine-2,4-diamine
CID 83265635
2-propan-2-yl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80957246
6-methoxy-2-N-(5-methylhexan-2-yl)pyridine-2,5-diamine
CID 63928133
N-(1-thiophen-3-ylethyl)pyrimidin-5-amine
CID 107588181
N-(1-thiophen-3-ylethyl)pyrazin-2-amine
CID 62845252
2-chloro-6-(1-thiophen-3-ylethylamino)pyridine-4-carbonitrile
CID 83076667
2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide
CID 54950923
4-N-ethyl-6-methoxy-2-N-(1-thiophen-3-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80825243
1-thiophen-3-yl-N-(1-thiophen-3-ylethyl)ethanamine
CID 14249916
4-methyl-N-(1-thiophen-3-ylethyl)-1,3-thiazol-2-amine
CID 62842792

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
The IUPAC name of 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine (CID 55121867) is 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine.
What is the SMILES notation for 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
The canonical SMILES for 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine is COc1nc(NC(C)c2ccsc2)ccc1N.
What is the InChIKey of 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
The InChIKey is HWQLINPHGYPQDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-8(9-5-6-17-7-9)14-11-4-3-10(13)12(15-11)16-2/h3-8H,13H2,1-2H3,(H,14,15).
What are the key properties of 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine?
6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine has a molecular weight of 249.34 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(1-thiophen-3-ylethyl)pyridine-2,5-diamine is sourced from PubChem (CID 55121867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).