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

C7H11N3S — CID 100917390

IUPAC2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
SMILESCCn1nc2c(c1N)CSC2
InChIInChI=1S/C7H11N3S/c1-2-10-7(8)5-3-11-4-6(5)9-10/h2-4,8H2,1H3
InChIKeyAGUWYVBJYZUNIY-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.23
Rot. Bonds1

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

2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine (PubChem CID 100917390) has the molecular formula C7H11N3S and a molecular weight of 169.25 g/mol. Its IUPAC name is 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
PubChem CID100917390
Molecular FormulaC7H11N3S
Molecular Weight169.25 g/mol
Exact Mass169.07
IUPAC Name2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
SMILESCCn1nc2c(c1N)CSC2
InChIInChI=1S/C7H11N3S/c1-2-10-7(8)5-3-11-4-6(5)9-10/h2-4,8H2,1H3
InChIKeyAGUWYVBJYZUNIY-UHFFFAOYSA-N
XLogP1.23
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.23
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
3-(5-Amino-3,4-dimethyl-1h-pyrazol-1-yl)tetrahydrothiophene 1,1-dioxide
CID 43159025
1-ethyl-3,4-dimethyl-1H-pyrazol-5-amine
CID 57549030
2-Propan-2-yl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine
CID 59050134
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
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-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The IUPAC name of 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine (CID 100917390) is 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The canonical SMILES for 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine is CCn1nc2c(c1N)CSC2.
What is the InChIKey of 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
The InChIKey is AGUWYVBJYZUNIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3S/c1-2-10-7(8)5-3-11-4-6(5)9-10/h2-4,8H2,1H3.
What are the key properties of 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine?
2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine has a molecular weight of 169.25 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,6-dihydrothieno[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 100917390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).