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

C13H16BrN3S — CID 105202756

IUPAC[1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
SMILESCc1csc(CC(Cc2cccc(Br)c2)NN)n1
InChIInChI=1S/C13H16BrN3S/c1-9-8-18-13(16-9)7-12(17-15)6-10-3-2-4-11(14)5-10/h2-5,8,12,17H,6-7,15H2,1H3
InChIKeyBAMICCVENKCJNB-UHFFFAOYSA-N
MW326.26 g/mol
LogP2.83
Rot. Bonds5

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

[1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine (PubChem CID 105202756) has the molecular formula C13H16BrN3S and a molecular weight of 326.26 g/mol. Its IUPAC name is [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
PubChem CID105202756
Molecular FormulaC13H16BrN3S
Molecular Weight326.26 g/mol
Exact Mass325.02
IUPAC Name[1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
SMILESCc1csc(CC(Cc2cccc(Br)c2)NN)n1
InChIInChI=1S/C13H16BrN3S/c1-9-8-18-13(16-9)7-12(17-15)6-10-3-2-4-11(14)5-10/h2-5,8,12,17H,6-7,15H2,1H3
InChIKeyBAMICCVENKCJNB-UHFFFAOYSA-N
XLogP2.83
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.26
LogP ≤ 52.83
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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Related Compounds

[1-(furan-3-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
CID 105214200
1-(3-fluorophenyl)-N-methyl-3-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 62794811
[1-(2-fluorophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
CID 105206934
[1-(6-methoxy-3-pyridinyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
CID 105250530
[1-(1-methylpyrazol-4-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
CID 105214243
[1-(4-bromo-2-methylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105326521
[1-(3-bromophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025177
[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
CID 105214128
[1-(3,5-dibromophenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 107979313
1-(3-bromophenyl)-N-methyl-3-(2-methyl-1,3-thiazol-4-yl)propan-2-amine
CID 62798989
1-(3-bromophenyl)heptan-2-ylhydrazine
CID 105202849
[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-phenylpropan-2-yl]hydrazine
CID 105195130

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine (CID 105202756) is [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine is Cc1csc(CC(Cc2cccc(Br)c2)NN)n1.
What is the InChIKey of [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
The InChIKey is BAMICCVENKCJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN3S/c1-9-8-18-13(16-9)7-12(17-15)6-10-3-2-4-11(14)5-10/h2-5,8,12,17H,6-7,15H2,1H3.
What are the key properties of [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
[1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine has a molecular weight of 326.26 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromophenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 105202756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).