[2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine

C12H16N4S — CID 62251669

IUPAC[2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1ccsc1-c1nc(NN)cc(C(C)C)n1
InChIInChI=1S/C12H16N4S/c1-7(2)9-6-10(16-13)15-12(14-9)11-8(3)4-5-17-11/h4-7H,13H2,1-3H3,(H,14,15,16)
InChIKeyXJVUXZBCNVBOKC-UHFFFAOYSA-N
MW248.35 g/mol
LogP2.92
Rot. Bonds3

About [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine

[2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 62251669) has the molecular formula C12H16N4S and a molecular weight of 248.35 g/mol. Its IUPAC name is [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID62251669
Molecular FormulaC12H16N4S
Molecular Weight248.35 g/mol
Exact Mass248.11
IUPAC Name[2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1ccsc1-c1nc(NN)cc(C(C)C)n1
InChIInChI=1S/C12H16N4S/c1-7(2)9-6-10(16-13)15-12(14-9)11-8(3)4-5-17-11/h4-7H,13H2,1-3H3,(H,14,15,16)
InChIKeyXJVUXZBCNVBOKC-UHFFFAOYSA-N
XLogP2.92
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 52.92
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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Related Compounds

4-chloro-2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidine
CID 43557747
[2-(2-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62251070
[6-propan-2-yl-2-(2,4,6-trimethylphenyl)pyrimidin-4-yl]hydrazine
CID 62251863
[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62251071
[2-(6-methyl-2-pyridinyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 63555982
[2-(2-methylpyrimidin-4-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 115528598
4-(4-hydrazinyl-6-propan-2-ylpyrimidin-2-yl)-N,N-dimethylaniline
CID 62250183
[2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62251478
[2-[(2-methylphenyl)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62252014
5,6-dimethyl-2-(3-methylthiophen-2-yl)pyrimidin-4-amine
CID 62203881
6-ethyl-2-(3-methylthiophen-2-yl)pyrimidin-4-amine
CID 62201574
[2-(4-fluoro-3-methoxyphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 107922925

Frequently Asked Questions

What is the IUPAC name of [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine (CID 62251669) is [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1ccsc1-c1nc(NN)cc(C(C)C)n1.
What is the InChIKey of [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is XJVUXZBCNVBOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4S/c1-7(2)9-6-10(16-13)15-12(14-9)11-8(3)4-5-17-11/h4-7H,13H2,1-3H3,(H,14,15,16).
What are the key properties of [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
[2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 248.35 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methylthiophen-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62251669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).