3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine

C10H17BrN4 — CID 105244614

IUPAC3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCN(C)CC(Cc1cncc(Br)c1)NN
InChIInChI=1S/C10H17BrN4/c1-15(2)7-10(14-12)4-8-3-9(11)6-13-5-8/h3,5-6,10,14H,4,7,12H2,1-2H3
InChIKeyFCFANDZFQZUPHL-UHFFFAOYSA-N
MW273.18 g/mol
LogP0.78
Rot. Bonds5

About 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine

3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine (PubChem CID 105244614) has the molecular formula C10H17BrN4 and a molecular weight of 273.18 g/mol. Its IUPAC name is 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
PubChem CID105244614
Molecular FormulaC10H17BrN4
Molecular Weight273.18 g/mol
Exact Mass272.06
IUPAC Name3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCN(C)CC(Cc1cncc(Br)c1)NN
InChIInChI=1S/C10H17BrN4/c1-15(2)7-10(14-12)4-8-3-9(11)6-13-5-8/h3,5-6,10,14H,4,7,12H2,1-2H3
InChIKeyFCFANDZFQZUPHL-UHFFFAOYSA-N
XLogP0.78
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.18
LogP ≤ 50.78
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 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine (CID 105244614) is 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine is CN(C)CC(Cc1cncc(Br)c1)NN.
What is the InChIKey of 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
The InChIKey is FCFANDZFQZUPHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17BrN4/c1-15(2)7-10(14-12)4-8-3-9(11)6-13-5-8/h3,5-6,10,14H,4,7,12H2,1-2H3.
What are the key properties of 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine has a molecular weight of 273.18 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-3-pyridinyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 105244614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).