[1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine

C15H21N3S — CID 105214705

IUPAC[1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine
SMILESCc1nc(CC(Cc2c(C)cccc2C)NN)cs1
InChIInChI=1S/C15H21N3S/c1-10-5-4-6-11(2)15(10)8-13(18-16)7-14-9-19-12(3)17-14/h4-6,9,13,18H,7-8,16H2,1-3H3
InChIKeyORAYGOKZWAPNRM-UHFFFAOYSA-N
MW275.42 g/mol
LogP2.69
Rot. Bonds5

About [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine

[1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine (PubChem CID 105214705) has the molecular formula C15H21N3S and a molecular weight of 275.42 g/mol. Its IUPAC name is [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine
PubChem CID105214705
Molecular FormulaC15H21N3S
Molecular Weight275.42 g/mol
Exact Mass275.15
IUPAC Name[1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine
SMILESCc1nc(CC(Cc2c(C)cccc2C)NN)cs1
InChIInChI=1S/C15H21N3S/c1-10-5-4-6-11(2)15(10)8-13(18-16)7-14-9-19-12(3)17-14/h4-6,9,13,18H,7-8,16H2,1-3H3
InChIKeyORAYGOKZWAPNRM-UHFFFAOYSA-N
XLogP2.69
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine?
The IUPAC name of [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine (CID 105214705) is [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine is Cc1nc(CC(Cc2c(C)cccc2C)NN)cs1.
What is the InChIKey of [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine?
The InChIKey is ORAYGOKZWAPNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S/c1-10-5-4-6-11(2)15(10)8-13(18-16)7-14-9-19-12(3)17-14/h4-6,9,13,18H,7-8,16H2,1-3H3.
What are the key properties of [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine?
[1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine has a molecular weight of 275.42 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 105214705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).