5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine

C8H9N5S — CID 135397018

IUPAC5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine
SMILESCNc1nnc(-c2ncccc2N)s1
InChIInChI=1S/C8H9N5S/c1-10-8-13-12-7(14-8)6-5(9)3-2-4-11-6/h2-4H,9H2,1H3,(H,10,13)
InChIKeyRIYIQQLMYLHNGY-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.22
Rot. Bonds2

About 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine

5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine (PubChem CID 135397018) has the molecular formula C8H9N5S and a molecular weight of 207.26 g/mol. Its IUPAC name is 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine
PubChem CID135397018
Molecular FormulaC8H9N5S
Molecular Weight207.26 g/mol
Exact Mass207.06
IUPAC Name5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine
SMILESCNc1nnc(-c2ncccc2N)s1
InChIInChI=1S/C8H9N5S/c1-10-8-13-12-7(14-8)6-5(9)3-2-4-11-6/h2-4H,9H2,1H3,(H,10,13)
InChIKeyRIYIQQLMYLHNGY-UHFFFAOYSA-N
XLogP1.22
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-thiadiazol-2-amine
CID 82452060
2-[4-methyl-5-(methylamino)-1,2,4-triazol-3-yl]pyridin-3-amine
CID 104743877
2-(1,2,4-thiadiazol-5-yl)pyridin-3-amine
CID 150465299
2-(5-methoxythiophen-2-yl)pyridin-3-amine
CID 130587807
2-(3,4-dimethoxyphenyl)pyridin-3-amine
CID 23075532
2-(5-methyl-1,3,4-thiadiazol-2-yl)pyridin-3-ol
CID 137314735
2-(1,2-thiazol-5-yl)pyridin-3-amine
CID 131151005
2-methyl-4-[5-(methylamino)-1,3,4-thiadiazol-2-yl]-6-pyridin-2-ylpyridazin-3-one
CID 82444689
2-(3-bromo-4-methylphenyl)pyridin-3-amine
CID 82379977
2-(2H-tetrazol-5-yl)pyridin-3-amine
CID 130862951
3-amino-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyridine-2-sulfonamide
CID 106261994
2-(5-bromo-3-methyltriazol-4-yl)pyridin-3-amine
CID 106463214

Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine (CID 135397018) is 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine is CNc1nnc(-c2ncccc2N)s1.
What is the InChIKey of 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine?
The InChIKey is RIYIQQLMYLHNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5S/c1-10-8-13-12-7(14-8)6-5(9)3-2-4-11-6/h2-4H,9H2,1H3,(H,10,13).
What are the key properties of 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine?
5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine has a molecular weight of 207.26 g/mol, XLogP of 1.22, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-amino-2-pyridinyl)-N-methyl-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 135397018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).