[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine

C15H21ClN4O — CID 105312734

IUPAC[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCOc1ccc(Cl)cc1C(Cc1ccn(C(C)C)n1)NN
InChIInChI=1S/C15H21ClN4O/c1-10(2)20-7-6-12(19-20)9-14(18-17)13-8-11(16)4-5-15(13)21-3/h4-8,10,14,18H,9,17H2,1-3H3
InChIKeyXGHNYMNSXDICBI-UHFFFAOYSA-N
MW308.81 g/mol
LogP2.87
Rot. Bonds6

About [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine

[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105312734) has the molecular formula C15H21ClN4O and a molecular weight of 308.81 g/mol. Its IUPAC name is [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105312734
Molecular FormulaC15H21ClN4O
Molecular Weight308.81 g/mol
Exact Mass308.14
IUPAC Name[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCOc1ccc(Cl)cc1C(Cc1ccn(C(C)C)n1)NN
InChIInChI=1S/C15H21ClN4O/c1-10(2)20-7-6-12(19-20)9-14(18-17)13-8-11(16)4-5-15(13)21-3/h4-8,10,14,18H,9,17H2,1-3H3
InChIKeyXGHNYMNSXDICBI-UHFFFAOYSA-N
XLogP2.87
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.81
LogP ≤ 52.87
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'}

Analyze [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(2-chloro-3-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312731
[1-(5-chloro-2-methoxyphenyl)-4-methylpentyl]hydrazine
CID 105207718
1-(5-chloro-2-fluorophenyl)-N-methyl-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 114886218
[1-(2-chloro-4-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105215278
[1-(5-chloro-2-methoxyphenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105200255
[1-(5-chloro-2-methoxyphenyl)-2-(3-chlorophenyl)ethyl]hydrazine
CID 105195086
[1-(2,5-dibromophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312747
[1-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 105209656
[1-(2-fluoro-3-methylphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105312794
[1-(5-chloro-2-methylphenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329657
[1-(5-chloro-2-methoxyphenyl)-2-(2,3-dichlorophenyl)ethyl]hydrazine
CID 107312860
[1-(3-fluoro-4-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105258519

Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine (CID 105312734) is [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine is COc1ccc(Cl)cc1C(Cc1ccn(C(C)C)n1)NN.
What is the InChIKey of [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is XGHNYMNSXDICBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN4O/c1-10(2)20-7-6-12(19-20)9-14(18-17)13-8-11(16)4-5-15(13)21-3/h4-8,10,14,18H,9,17H2,1-3H3.
What are the key properties of [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine?
[1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 308.81 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloro-2-methoxyphenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105312734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).