2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine

C10H15N5O2S2 — CID 103333992

IUPAC2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCC(CS(C)(=O)=O)Nc1nc(NN)nc2sccc12
InChIInChI=1S/C10H15N5O2S2/c1-6(5-19(2,16)17)12-8-7-3-4-18-9(7)14-10(13-8)15-11/h3-4,6H,5,11H2,1-2H3,(H2,12,13,14,15)
InChIKeyRCDXCFVKWLTPIV-UHFFFAOYSA-N
MW301.40 g/mol
LogP0.82
Rot. Bonds5

About 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine

2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 103333992) has the molecular formula C10H15N5O2S2 and a molecular weight of 301.40 g/mol. Its IUPAC name is 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID103333992
Molecular FormulaC10H15N5O2S2
Molecular Weight301.40 g/mol
Exact Mass301.07
IUPAC Name2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCC(CS(C)(=O)=O)Nc1nc(NN)nc2sccc12
InChIInChI=1S/C10H15N5O2S2/c1-6(5-19(2,16)17)12-8-7-3-4-18-9(7)14-10(13-8)15-11/h3-4,6H,5,11H2,1-2H3,(H2,12,13,14,15)
InChIKeyRCDXCFVKWLTPIV-UHFFFAOYSA-N
XLogP0.82
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.40
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

2-hydrazinyl-N-(5-methylhexan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103333804
N-(1-cyclopropylpropan-2-yl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103333826
2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)quinazolin-4-amine
CID 80915950
2-hydrazinyl-N-(1-morpholin-4-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103332803
N-[1-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 103333795
5-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]pentan-2-ol
CID 106138733
2-N-methyl-4-N-(4-methylpentan-2-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324758
4-N-[1-(dimethylamino)propan-2-yl]-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329471
2-hydrazinyl-N-(2-phenylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 103335640
3-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]butanamide
CID 103330351
4-N-(4-methoxybutan-2-yl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328328
2-N-ethyl-4-N-(4-methylhexan-2-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328574

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine (CID 103333992) is 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine is CC(CS(C)(=O)=O)Nc1nc(NN)nc2sccc12.
What is the InChIKey of 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is RCDXCFVKWLTPIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2S2/c1-6(5-19(2,16)17)12-8-7-3-4-18-9(7)14-10(13-8)15-11/h3-4,6H,5,11H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 301.40 g/mol, XLogP of 0.82, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(1-methylsulfonylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103333992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).