2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

C14H15N5OS — CID 103334767

IUPAC2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(C)cc1Nc1nc(NN)nc2sccc12
InChIInChI=1S/C14H15N5OS/c1-8-3-4-11(20-2)10(7-8)16-12-9-5-6-21-13(9)18-14(17-12)19-15/h3-7H,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyOQQLLWWVLHXKTK-UHFFFAOYSA-N
MW301.38 g/mol
LogP3.04
Rot. Bonds4

About 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 103334767) has the molecular formula C14H15N5OS and a molecular weight of 301.38 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID103334767
Molecular FormulaC14H15N5OS
Molecular Weight301.38 g/mol
Exact Mass301.10
IUPAC Name2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(C)cc1Nc1nc(NN)nc2sccc12
InChIInChI=1S/C14H15N5OS/c1-8-3-4-11(20-2)10(7-8)16-12-9-5-6-21-13(9)18-14(17-12)19-15/h3-7H,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyOQQLLWWVLHXKTK-UHFFFAOYSA-N
XLogP3.04
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

N-(2-bromo-5-methylphenyl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335513
2-hydrazinyl-N-(2-iodophenyl)thieno[2,3-d]pyrimidin-4-amine
CID 103334778
[4-(2-fluoro-5-methylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336348
2-hydrazinyl-N-[(4-methylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 103335344
4-N-(2-fluoro-5-methylphenyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103323320
N-(4-bromo-2-ethylphenyl)-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335460
3,5-dichloro-6-hydrazinyl-N-(2-methoxy-5-methylphenyl)pyridin-2-amine
CID 102762320
5-fluoro-2-[(2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]benzonitrile
CID 103335500
2-hydrazinyl-N-thiophen-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 103334460
2-hydrazinyl-N-(2-methoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103333298
[4-(4-methylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336141
4-N-(2-chloro-4-methylphenyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103323332

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine (CID 103334767) is 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine is COc1ccc(C)cc1Nc1nc(NN)nc2sccc12.
What is the InChIKey of 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is OQQLLWWVLHXKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c1-8-3-4-11(20-2)10(7-8)16-12-9-5-6-21-13(9)18-14(17-12)19-15/h3-7H,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 301.38 g/mol, XLogP of 3.04, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2-methoxy-5-methylphenyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 103334767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).