6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine

C13H10N4S — CID 102035630

IUPAC6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine
SMILESNc1c(/C=N/c2ccccc2)sc2nccnc12
InChIInChI=1S/C13H10N4S/c14-11-10(8-17-9-4-2-1-3-5-9)18-13-12(11)15-6-7-16-13/h1-8H,14H2/b17-8+
InChIKeyIGUFWYDQRVLATG-CAOOACKPSA-N
MW254.32 g/mol
LogP3.02
Rot. Bonds2

About 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine

6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine (PubChem CID 102035630) has the molecular formula C13H10N4S and a molecular weight of 254.32 g/mol. Its IUPAC name is 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine.

Molecular Properties

Compound Name6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine
PubChem CID102035630
Molecular FormulaC13H10N4S
Molecular Weight254.32 g/mol
Exact Mass254.06
IUPAC Name6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine
SMILESNc1c(/C=N/c2ccccc2)sc2nccnc12
InChIInChI=1S/C13H10N4S/c14-11-10(8-17-9-4-2-1-3-5-9)18-13-12(11)15-6-7-16-13/h1-8H,14H2/b17-8+
InChIKeyIGUFWYDQRVLATG-CAOOACKPSA-N
XLogP3.02
TPSA64.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.32
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-(2-Pyridinyl)benzothiazole
CID 12856
3-Amino-4-anilinothieno[2,3-b]pyridine-2-carbonitrile
CID 793761
2-(Pyridin-2-ylsulfanylmethyl)-1,3-benzothiazole
CID 2417513
2-([1,3]Thiazolo[5,4-b]pyridin-2-yldisulfanyl)-[1,3]thiazolo[5,4-b]pyridine
CID 137661735
2-(3-Pyridyl)benzothiazole
CID 235922
2-Pyridin-4-yl-1,3-benzothiazole
CID 236319
[1,3]Thiazolo[5,4-b]pyridin-2-amine
CID 592050
2-Methyl-[1,3]thiazolo[4,5-c]pyridine
CID 640721
2-Chloro-[1,3]thiazolo[5,4-b]pyridine
CID 13342803
N,N-dimethyl-2-(3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaen-8-ylsulfanyl)ethanamine
CID 101747513
2-Methyl-N-4-pyridinyl-6-benzothiazolamine
CID 2235649
Benzothiazole, 2-[(2-pyridinylmethyl)thio]-
CID 785710

Frequently Asked Questions

What is the IUPAC name of 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine?
The IUPAC name of 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine (CID 102035630) is 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine.
What is the SMILES notation for 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine?
The canonical SMILES for 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine is Nc1c(/C=N/c2ccccc2)sc2nccnc12.
What is the InChIKey of 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine?
The InChIKey is IGUFWYDQRVLATG-CAOOACKPSA-N. The full InChI is InChI=1S/C13H10N4S/c14-11-10(8-17-9-4-2-1-3-5-9)18-13-12(11)15-6-7-16-13/h1-8H,14H2/b17-8+.
What are the key properties of 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine?
6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine has a molecular weight of 254.32 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(phenyliminomethyl)thieno[2,3-b]pyrazin-7-amine is sourced from PubChem (CID 102035630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).