4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine

C9H7N7S — CID 62111630

IUPAC4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine
SMILESNc1cnccc1Sc1cncc2nnnn12
InChIInChI=1S/C9H7N7S/c10-6-3-11-2-1-7(6)17-9-5-12-4-8-13-14-15-16(8)9/h1-5H,10H2
InChIKeyZBBILVKMZZVCHG-UHFFFAOYSA-N
MW245.27 g/mol
LogP0.65
Rot. Bonds2

About 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine

4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine (PubChem CID 62111630) has the molecular formula C9H7N7S and a molecular weight of 245.27 g/mol. Its IUPAC name is 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine.

Molecular Properties

Compound Name4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine
PubChem CID62111630
Molecular FormulaC9H7N7S
Molecular Weight245.27 g/mol
Exact Mass245.05
IUPAC Name4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine
SMILESNc1cnccc1Sc1cncc2nnnn12
InChIInChI=1S/C9H7N7S/c10-6-3-11-2-1-7(6)17-9-5-12-4-8-13-14-15-16(8)9/h1-5H,10H2
InChIKeyZBBILVKMZZVCHG-UHFFFAOYSA-N
XLogP0.65
TPSA94.88 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.27
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)phenyl]acetic acid
CID 64927980
4-(5-bromopyrimidin-2-yl)sulfanylpyridin-3-amine
CID 63872669
methyl 3-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)butanoate
CID 66113967
4-[(5-bromo-2-pyridinyl)sulfanyl]pyridin-3-amine
CID 62112804
4-(5-chloropyrazin-2-yl)sulfanylpyridin-3-amine
CID 142433853
4-(2,5-dimethylphenyl)sulfanylpyridin-3-amine
CID 28890544
4-(1,2,4-thiadiazol-5-ylsulfanyl)pyridin-3-amine
CID 65275012
2-acetamido-3-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)propanoic acid
CID 107768343
3-[(3-amino-4-pyridinyl)sulfanyl]-1-methylpyrazin-2-one
CID 62939764
1-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-yl)ethanamine
CID 63196327
4-(2,6-dimethylpyrimidin-4-yl)sulfanylpyridin-3-amine
CID 62112470
4,5-dichloro-2-(tetrazolo[1,5-a]pyrazin-5-yloxy)aniline
CID 107501213

Frequently Asked Questions

What is the IUPAC name of 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine?
The IUPAC name of 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine (CID 62111630) is 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine.
What is the SMILES notation for 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine?
The canonical SMILES for 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine is Nc1cnccc1Sc1cncc2nnnn12.
What is the InChIKey of 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine?
The InChIKey is ZBBILVKMZZVCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N7S/c10-6-3-11-2-1-7(6)17-9-5-12-4-8-13-14-15-16(8)9/h1-5H,10H2.
What are the key properties of 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine?
4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine has a molecular weight of 245.27 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(tetrazolo[1,5-a]pyrazin-5-ylsulfanyl)pyridin-3-amine is sourced from PubChem (CID 62111630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).