2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine

C11H12N6OS — CID 103333206

IUPAC2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc(CNc2nc(NN)nc3sccc23)on1
InChIInChI=1S/C11H12N6OS/c1-6-4-7(18-17-6)5-13-9-8-2-3-19-10(8)15-11(14-9)16-12/h2-4H,5,12H2,1H3,(H2,13,14,15,16)
InChIKeyHNYDEUNDFVBQKH-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.89
Rot. Bonds4

About 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine

2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine (PubChem CID 103333206) has the molecular formula C11H12N6OS and a molecular weight of 276.32 g/mol. Its IUPAC name is 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
PubChem CID103333206
Molecular FormulaC11H12N6OS
Molecular Weight276.32 g/mol
Exact Mass276.08
IUPAC Name2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc(CNc2nc(NN)nc3sccc23)on1
InChIInChI=1S/C11H12N6OS/c1-6-4-7(18-17-6)5-13-9-8-2-3-19-10(8)15-11(14-9)16-12/h2-4H,5,12H2,1H3,(H2,13,14,15,16)
InChIKeyHNYDEUNDFVBQKH-UHFFFAOYSA-N
XLogP1.89
TPSA101.89 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.89
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'}

Analyze 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

2-hydrazinyl-N-[(4-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 103335344
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 106379043
2-hydrazinyl-N-(1,3-thiazol-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103333777
2-N-methyl-4-N-(1,2-oxazol-5-ylmethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 106424574
3-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]propan-1-ol
CID 103335379
3-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]-2-methylpropane-1,2-diol
CID 103334449
2-hydrazinyl-N-(4-methylsulfanylbutyl)thieno[2,3-d]pyrimidin-4-amine
CID 103335722
N'-(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 103335219
5-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]pentan-2-ol
CID 106138733
3-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]propanamide
CID 103332330
5-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]pentan-1-ol
CID 107324351
1-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]pentan-3-ol
CID 103335755

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine (CID 103333206) is 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine is Cc1cc(CNc2nc(NN)nc3sccc23)on1.
What is the InChIKey of 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is HNYDEUNDFVBQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6OS/c1-6-4-7(18-17-6)5-13-9-8-2-3-19-10(8)15-11(14-9)16-12/h2-4H,5,12H2,1H3,(H2,13,14,15,16).
What are the key properties of 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine?
2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 276.32 g/mol, XLogP of 1.89, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103333206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).