[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine

C15H22N4 — CID 107332493

IUPAC[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine
SMILESCC(C)C(C)C(NN)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H22N4/c1-11(2)12(3)15(18-16)14-9-10-17-19(14)13-7-5-4-6-8-13/h4-12,15,18H,16H2,1-3H3
InChIKeyKXLNGQCUMKAXIP-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.67
Rot. Bonds5

About [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine

[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine (PubChem CID 107332493) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine.

Molecular Properties

Compound Name[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine
PubChem CID107332493
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine
SMILESCC(C)C(C)C(NN)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H22N4/c1-11(2)12(3)15(18-16)14-9-10-17-19(14)13-7-5-4-6-8-13/h4-12,15,18H,16H2,1-3H3
InChIKeyKXLNGQCUMKAXIP-UHFFFAOYSA-N
XLogP2.67
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.67
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

N,2-dimethyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107330520
2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butan-1-ol
CID 107332293
[1-(2-ethylpyrazol-3-yl)-2,3-dimethylbutyl]hydrazine
CID 105307274
2-(2-phenylpyrazol-3-yl)propan-1-amine
CID 105453704
N-ethyl-2-methoxy-3-methyl-1-(2-phenylpyrazol-3-yl)butan-1-amine
CID 107330894
[(1-methylpyrazol-4-yl)-(2-phenylpyrazol-3-yl)methyl]hydrazine
CID 107332407
[(5-methylpyrazin-2-yl)-(2-phenylpyrazol-3-yl)methyl]hydrazine
CID 107332508
N-ethyl-2,2-dimethyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107330534
(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107330866
N-ethyl-3-methyl-1-(2-phenylpyrazol-3-yl)butan-1-amine
CID 107330516
(5-methylfuran-2-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332054
(2-methylphenyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107330490

Frequently Asked Questions

What is the IUPAC name of [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine?
The IUPAC name of [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine (CID 107332493) is [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine.
What is the SMILES notation for [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine?
The canonical SMILES for [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine is CC(C)C(C)C(NN)c1ccnn1-c1ccccc1.
What is the InChIKey of [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine?
The InChIKey is KXLNGQCUMKAXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-11(2)12(3)15(18-16)14-9-10-17-19(14)13-7-5-4-6-8-13/h4-12,15,18H,16H2,1-3H3.
What are the key properties of [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine?
[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine has a molecular weight of 258.37 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine is sourced from PubChem (CID 107332493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).