2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine

C12H10IN5S — CID 103334778

IUPAC2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESNNc1nc(Nc2ccccc2I)c2ccsc2n1
InChIInChI=1S/C12H10IN5S/c13-8-3-1-2-4-9(8)15-10-7-5-6-19-11(7)17-12(16-10)18-14/h1-6H,14H2,(H2,15,16,17,18)
InChIKeyOUKQKXWLWFANEZ-UHFFFAOYSA-N
MW383.22 g/mol
LogP3.33
Rot. Bonds3

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

2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 103334778) has the molecular formula C12H10IN5S and a molecular weight of 383.22 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID103334778
Molecular FormulaC12H10IN5S
Molecular Weight383.22 g/mol
Exact Mass382.97
IUPAC Name2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESNNc1nc(Nc2ccccc2I)c2ccsc2n1
InChIInChI=1S/C12H10IN5S/c13-8-3-1-2-4-9(8)15-10-7-5-6-19-11(7)17-12(16-10)18-14/h1-6H,14H2,(H2,15,16,17,18)
InChIKeyOUKQKXWLWFANEZ-UHFFFAOYSA-N
XLogP3.33
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.22
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromo-5-methylphenyl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335513
2-hydrazinyl-N-thiophen-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 103334460
5-fluoro-2-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]benzonitrile
CID 103335500
2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 103334767
N-(4-bromo-2-ethylphenyl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335460
4-N-(2-bromophenyl)-2-N-ethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103323599
2-hydrazinyl-N-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 103332450
2-hydrazinyl-N-(2-phenylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 103335640
3-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]propan-1-ol
CID 103335379
N'-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 103335219
2-hydrazinyl-N-(1,3-thiazol-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103333777
(4-phenylsulfanylthieno[2,3-d]pyrimidin-2-yl)hydrazine
CID 103336515

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine (CID 103334778) is 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine is NNc1nc(Nc2ccccc2I)c2ccsc2n1.
What is the InChIKey of 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is OUKQKXWLWFANEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10IN5S/c13-8-3-1-2-4-9(8)15-10-7-5-6-19-11(7)17-12(16-10)18-14/h1-6H,14H2,(H2,15,16,17,18).
What are the key properties of 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine?
2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 383.22 g/mol, XLogP of 3.33, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103334778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).