[(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine

C12H15Br2N5 — CID 114198124

IUPAC[(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine
SMILESCC(C)n1nccc1C(NN)c1ncc(Br)cc1Br
InChIInChI=1S/C12H15Br2N5/c1-7(2)19-10(3-4-17-19)12(18-15)11-9(14)5-8(13)6-16-11/h3-7,12,18H,15H2,1-2H3
InChIKeyRURJKYBKHQWNBD-UHFFFAOYSA-N
MW389.10 g/mol
LogP2.94
Rot. Bonds4

About [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine

[(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine (PubChem CID 114198124) has the molecular formula C12H15Br2N5 and a molecular weight of 389.10 g/mol. Its IUPAC name is [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine
PubChem CID114198124
Molecular FormulaC12H15Br2N5
Molecular Weight389.10 g/mol
Exact Mass386.97
IUPAC Name[(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine
SMILESCC(C)n1nccc1C(NN)c1ncc(Br)cc1Br
InChIInChI=1S/C12H15Br2N5/c1-7(2)19-10(3-4-17-19)12(18-15)11-9(14)5-8(13)6-16-11/h3-7,12,18H,15H2,1-2H3
InChIKeyRURJKYBKHQWNBD-UHFFFAOYSA-N
XLogP2.94
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.10
LogP ≤ 52.94
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

[(3,5-dibromo-2-pyridinyl)-(furan-2-yl)methyl]hydrazine
CID 105268276
[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dibromo-2-pyridinyl)methyl]hydrazine
CID 105268450
[(4-chlorophenyl)-(3,5-dibromo-2-pyridinyl)methyl]hydrazine
CID 105268377
N-[(4-bromo-1-propan-2-ylpyrazol-5-yl)-(3,5-dibromo-2-pyridinyl)methyl]ethanamine
CID 114660611
1-(3,5-dibromo-2-pyridinyl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylmethanamine
CID 114660600
N-[(4-chloro-1-propan-2-ylpyrazol-5-yl)-(3,5-dibromo-2-pyridinyl)methyl]ethanamine
CID 114660608
[(3-chlorothiophen-2-yl)-(3,5-dibromo-2-pyridinyl)methyl]hydrazine
CID 107362173
1-(3,5-dibromo-2-pyridinyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 113398604
[1-(3,5-dibromo-2-pyridinyl)-5-methylhexyl]hydrazine
CID 105268552
[1-(3,5-dibromo-2-pyridinyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105268547
[(4-bromo-1-propan-2-ylpyrazol-5-yl)-pyrimidin-4-ylmethyl]hydrazine
CID 105220898
2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol
CID 83388208

Frequently Asked Questions

What is the IUPAC name of [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine?
The IUPAC name of [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine (CID 114198124) is [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine is CC(C)n1nccc1C(NN)c1ncc(Br)cc1Br.
What is the InChIKey of [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine?
The InChIKey is RURJKYBKHQWNBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Br2N5/c1-7(2)19-10(3-4-17-19)12(18-15)11-9(14)5-8(13)6-16-11/h3-7,12,18H,15H2,1-2H3.
What are the key properties of [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine?
[(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine has a molecular weight of 389.10 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dibromo-2-pyridinyl)-(2-propan-2-ylpyrazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 114198124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).