(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine

C9H14N4S — CID 83200451

IUPAC(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine
SMILESCC(C)c1nc2c(c(NN)n1)CSC2
InChIInChI=1S/C9H14N4S/c1-5(2)8-11-7-4-14-3-6(7)9(12-8)13-10/h5H,3-4,10H2,1-2H3,(H,11,12,13)
InChIKeyDFJDCQOKGAPNEC-UHFFFAOYSA-N
MW210.31 g/mol
LogP1.63
Rot. Bonds2

About (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine

(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine (PubChem CID 83200451) has the molecular formula C9H14N4S and a molecular weight of 210.31 g/mol. Its IUPAC name is (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine
PubChem CID83200451
Molecular FormulaC9H14N4S
Molecular Weight210.31 g/mol
Exact Mass210.09
IUPAC Name(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine
SMILESCC(C)c1nc2c(c(NN)n1)CSC2
InChIInChI=1S/C9H14N4S/c1-5(2)8-11-7-4-14-3-6(7)9(12-8)13-10/h5H,3-4,10H2,1-2H3,(H,11,12,13)
InChIKeyDFJDCQOKGAPNEC-UHFFFAOYSA-N
XLogP1.63
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.31
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine?
The IUPAC name of (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine (CID 83200451) is (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine?
The canonical SMILES for (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine is CC(C)c1nc2c(c(NN)n1)CSC2.
What is the InChIKey of (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine?
The InChIKey is DFJDCQOKGAPNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4S/c1-5(2)8-11-7-4-14-3-6(7)9(12-8)13-10/h5H,3-4,10H2,1-2H3,(H,11,12,13).
What are the key properties of (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine?
(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine has a molecular weight of 210.31 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine is sourced from PubChem (CID 83200451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).