4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine

C8H10N6OS — CID 107052262

IUPAC4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine
SMILESCn1nnc(CS(=O)c2ccncc2N)n1
InChIInChI=1S/C8H10N6OS/c1-14-12-8(11-13-14)5-16(15)7-2-3-10-4-6(7)9/h2-4H,5,9H2,1H3
InChIKeyURYQVAHZWIOYCF-UHFFFAOYSA-N
MW238.28 g/mol
LogP-0.50
Rot. Bonds3

About 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine

4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine (PubChem CID 107052262) has the molecular formula C8H10N6OS and a molecular weight of 238.28 g/mol. Its IUPAC name is 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine.

Molecular Properties

Compound Name4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine
PubChem CID107052262
Molecular FormulaC8H10N6OS
Molecular Weight238.28 g/mol
Exact Mass238.06
IUPAC Name4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine
SMILESCn1nnc(CS(=O)c2ccncc2N)n1
InChIInChI=1S/C8H10N6OS/c1-14-12-8(11-13-14)5-16(15)7-2-3-10-4-6(7)9/h2-4H,5,9H2,1H3
InChIKeyURYQVAHZWIOYCF-UHFFFAOYSA-N
XLogP-0.50
TPSA99.58 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(pyridin-3-ylmethylsulfinyl)pyridin-3-amine
CID 62111987
4-[(5-methyl-3-pyridinyl)methylsulfinyl]pyridin-3-amine
CID 102878475
4-[(2-methoxyphenyl)methylsulfinyl]pyridin-3-amine
CID 62113991
4-[(3-fluoro-4-methoxyphenyl)methylsulfinyl]pyridin-3-amine
CID 62112986
4-(3-pyrrolidin-1-ylpropylsulfinyl)pyridin-3-amine
CID 62112145
2-[(2-methyltetrazol-5-yl)methylsulfinyl]-3H-benzimidazol-5-amine
CID 107052253
2-[(2-methyltetrazol-5-yl)methylsulfinyl]ethanamine
CID 107059372
1-(4-methyl-3-pyridinyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107051303
1-(3-methyl-4-pyridinyl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107047405
2-methyl-1-[(2-methyltetrazol-5-yl)methylsulfinyl]propan-2-amine
CID 107059489
4-[2-(3-methylbutoxy)ethylsulfinyl]pyridin-3-amine
CID 62113145
2-[(3-amino-4-pyridinyl)sulfinyl]-N-methyl-N-propan-2-ylacetamide
CID 62113814

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine?
The IUPAC name of 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine (CID 107052262) is 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine.
What is the SMILES notation for 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine?
The canonical SMILES for 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine is Cn1nnc(CS(=O)c2ccncc2N)n1.
What is the InChIKey of 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine?
The InChIKey is URYQVAHZWIOYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6OS/c1-14-12-8(11-13-14)5-16(15)7-2-3-10-4-6(7)9/h2-4H,5,9H2,1H3.
What are the key properties of 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine?
4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine has a molecular weight of 238.28 g/mol, XLogP of -0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methyltetrazol-5-yl)methylsulfinyl]pyridin-3-amine is sourced from PubChem (CID 107052262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).