2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine

C6H9N3S — CID 45121297

IUPAC2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
SMILESCn1nc2c(c1N)CSC2
InChIInChI=1S/C6H9N3S/c1-9-6(7)4-2-10-3-5(4)8-9/h2-3,7H2,1H3
InChIKeyKGKMOASZDHGIJC-UHFFFAOYSA-N
MW155.23 g/mol
LogP0.75
Rot. Bonds

About 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine

2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine (PubChem CID 45121297) has the molecular formula C6H9N3S and a molecular weight of 155.23 g/mol. Its IUPAC name is 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
PubChem CID45121297
Molecular FormulaC6H9N3S
Molecular Weight155.23 g/mol
Exact Mass155.05
IUPAC Name2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
SMILESCn1nc2c(c1N)CSC2
InChIInChI=1S/C6H9N3S/c1-9-6(7)4-2-10-3-5(4)8-9/h2-3,7H2,1H3
InChIKeyKGKMOASZDHGIJC-UHFFFAOYSA-N
XLogP0.75
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.23
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The IUPAC name of 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine (CID 45121297) is 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The canonical SMILES for 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine is Cn1nc2c(c1N)CSC2.
What is the InChIKey of 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The InChIKey is KGKMOASZDHGIJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3S/c1-9-6(7)4-2-10-3-5(4)8-9/h2-3,7H2,1H3.
What are the key properties of 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine has a molecular weight of 155.23 g/mol, XLogP of 0.75, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 45121297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).