[2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine

C14H20N4OS — CID 81000733

IUPAC[2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine
SMILESCc1c(NN)nc(C(C)(C)C)nc1OCc1cccs1
InChIInChI=1S/C14H20N4OS/c1-9-11(18-15)16-13(14(2,3)4)17-12(9)19-8-10-6-5-7-20-10/h5-7H,8,15H2,1-4H3,(H,16,17,18)
InChIKeyYCAXKQUADMVTCD-UHFFFAOYSA-N
MW292.41 g/mol
LogP3.01
Rot. Bonds4

About [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine

[2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine (PubChem CID 81000733) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine
PubChem CID81000733
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name[2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine
SMILESCc1c(NN)nc(C(C)(C)C)nc1OCc1cccs1
InChIInChI=1S/C14H20N4OS/c1-9-11(18-15)16-13(14(2,3)4)17-12(9)19-8-10-6-5-7-20-10/h5-7H,8,15H2,1-4H3,(H,16,17,18)
InChIKeyYCAXKQUADMVTCD-UHFFFAOYSA-N
XLogP3.01
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine 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

[3,5-dichloro-6-(thiophen-2-ylmethoxy)-2-pyridinyl]hydrazine
CID 102762979
2-tert-butyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80962886
5-methyl-2-propan-2-yl-N-propyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990902
[2-tert-butyl-5-methyl-6-(2-propoxyethoxy)pyrimidin-4-yl]hydrazine
CID 81001737
5-methyl-N-propyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80872234
2-cyclopropyl-N,5-dimethyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990031
5-methyl-2-propan-2-yl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990262
2-tert-butyl-4-N,6-N,5-trimethyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80986264
(2,5-dimethyl-6-phenylmethoxypyrimidin-4-yl)hydrazine
CID 80910056
2-cyclopropyl-6-hydrazinyl-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 81000587
5-methyl-6-(thiophen-2-ylmethoxy)pyridin-3-amine
CID 62475410
2-tert-butyl-6-hydrazinyl-5-methyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 81000690

Frequently Asked Questions

What is the IUPAC name of [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine (CID 81000733) is [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine is Cc1c(NN)nc(C(C)(C)C)nc1OCc1cccs1.
What is the InChIKey of [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is YCAXKQUADMVTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS/c1-9-11(18-15)16-13(14(2,3)4)17-12(9)19-8-10-6-5-7-20-10/h5-7H,8,15H2,1-4H3,(H,16,17,18).
What are the key properties of [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine?
[2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 292.41 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-tert-butyl-5-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 81000733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).