[1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine

C14H19BrN4O — CID 103026148

IUPAC[1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCOc1ccc(C(CCc2ccnn2C)NN)cc1Br
InChIInChI=1S/C14H19BrN4O/c1-19-11(7-8-17-19)4-5-13(18-16)10-3-6-14(20-2)12(15)9-10/h3,6-9,13,18H,4-5,16H2,1-2H3
InChIKeyFWHWMOMALYWTEL-UHFFFAOYSA-N
MW339.24 g/mol
LogP2.33
Rot. Bonds6

About [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine

[1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine (PubChem CID 103026148) has the molecular formula C14H19BrN4O and a molecular weight of 339.24 g/mol. Its IUPAC name is [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
PubChem CID103026148
Molecular FormulaC14H19BrN4O
Molecular Weight339.24 g/mol
Exact Mass338.07
IUPAC Name[1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
SMILESCOc1ccc(C(CCc2ccnn2C)NN)cc1Br
InChIInChI=1S/C14H19BrN4O/c1-19-11(7-8-17-19)4-5-13(18-16)10-3-6-14(20-2)12(15)9-10/h3,6-9,13,18H,4-5,16H2,1-2H3
InChIKeyFWHWMOMALYWTEL-UHFFFAOYSA-N
XLogP2.33
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.24
LogP ≤ 52.33
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

[1-(2,4-dibromophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 107948596
[1-(3-bromo-4-methoxyphenyl)-3-thiophen-2-ylpropyl]hydrazine
CID 105308969
[1-(3-chloro-4-iodophenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103217868
[1-(3-bromo-4-methoxyphenyl)-2-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105315855
[1-(4-bromothiophen-2-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103026739
[1-(3-bromo-4-methoxyphenyl)-3-cyclopropylpropyl]hydrazine
CID 105315194
[1-(3-bromo-4-methoxyphenyl)-3-methylsulfonylpropyl]hydrazine
CID 114985195
[2-(4-bromo-1,3-dimethylpyrazol-5-yl)-1-(3-bromo-4-methoxyphenyl)ethyl]hydrazine
CID 105317885
1-(3-bromo-4-methoxyphenyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 115858716
1-(3-methoxy-4-pyridinyl)-N-methyl-3-(2-methylpyrazol-3-yl)propan-1-amine
CID 103030781
[1-(3-bromo-4-methoxyphenyl)-3-methylpentyl]hydrazine
CID 105298627
1-(3-bromo-4-methoxyphenyl)-3-(1-methylimidazol-2-yl)propan-1-ol
CID 114529049

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The IUPAC name of [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine (CID 103026148) is [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The canonical SMILES for [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine is COc1ccc(C(CCc2ccnn2C)NN)cc1Br.
What is the InChIKey of [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
The InChIKey is FWHWMOMALYWTEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN4O/c1-19-11(7-8-17-19)4-5-13(18-16)10-3-6-14(20-2)12(15)9-10/h3,6-9,13,18H,4-5,16H2,1-2H3.
What are the key properties of [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine?
[1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine has a molecular weight of 339.24 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-4-methoxyphenyl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine is sourced from PubChem (CID 103026148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).