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

C8H13N3S — CID 59050134

IUPAC2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
SMILESCC(C)n1nc2c(c1N)CSC2
InChIInChI=1S/C8H13N3S/c1-5(2)11-8(9)6-3-12-4-7(6)10-11/h5H,3-4,9H2,1-2H3
InChIKeyRHUWMNNNLOMLLL-UHFFFAOYSA-N
MW183.28 g/mol
LogP1.79
Rot. Bonds1

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

2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine (PubChem CID 59050134) has the molecular formula C8H13N3S and a molecular weight of 183.28 g/mol. Its IUPAC name is 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
PubChem CID59050134
Molecular FormulaC8H13N3S
Molecular Weight183.28 g/mol
Exact Mass183.08
IUPAC Name2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
SMILESCC(C)n1nc2c(c1N)CSC2
InChIInChI=1S/C8H13N3S/c1-5(2)11-8(9)6-3-12-4-7(6)10-11/h5H,3-4,9H2,1-2H3
InChIKeyRHUWMNNNLOMLLL-UHFFFAOYSA-N
XLogP1.79
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methyl-2,6-dihydro-4H-thieno(3,4-c)pyrazol-3-amine
CID 45121297
2-tert-Butyl-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-ylamine
CID 2049329
5-Amino-1-ethyl-3-methylpyrazole-4-carbothioamide
CID 13496612
1-(1,1-Dioxothiolan-3-yl)-4-methyl-3-(trifluoromethyl)pyrazol-5-amine
CID 43159021
2-Butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
CID 15358849
2-Ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
CID 100917390
3-(5-Amino-3,4-dimethyl-1h-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide
CID 43159025
5-Oxo-2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
CID 59050136
N-(2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)acetamide
CID 59050142
N-(5-oxo-2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)acetamide
CID 59050143
5,5-Dioxo-2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
CID 59050152
N-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)methanesulfonamide
CID 59820668

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The IUPAC name of 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine (CID 59050134) is 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The canonical SMILES for 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine is CC(C)n1nc2c(c1N)CSC2.
What is the InChIKey of 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The InChIKey is RHUWMNNNLOMLLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3S/c1-5(2)11-8(9)6-3-12-4-7(6)10-11/h5H,3-4,9H2,1-2H3.
What are the key properties of 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine has a molecular weight of 183.28 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 59050134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).