[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine

C12H23ClN4O — CID 103025367

IUPAC[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
SMILESCOC(C)(C)CC(Cc1c(Cl)c(C)nn1C)NN
InChIInChI=1S/C12H23ClN4O/c1-8-11(13)10(17(4)16-8)6-9(15-14)7-12(2,3)18-5/h9,15H,6-7,14H2,1-5H3
InChIKeyGTRLJUHRPOUSGX-UHFFFAOYSA-N
MW274.80 g/mol
LogP1.57
Rot. Bonds6

About [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine

[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine (PubChem CID 103025367) has the molecular formula C12H23ClN4O and a molecular weight of 274.80 g/mol. Its IUPAC name is [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
PubChem CID103025367
Molecular FormulaC12H23ClN4O
Molecular Weight274.80 g/mol
Exact Mass274.16
IUPAC Name[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
SMILESCOC(C)(C)CC(Cc1c(Cl)c(C)nn1C)NN
InChIInChI=1S/C12H23ClN4O/c1-8-11(13)10(17(4)16-8)6-9(15-14)7-12(2,3)18-5/h9,15H,6-7,14H2,1-5H3
InChIKeyGTRLJUHRPOUSGX-UHFFFAOYSA-N
XLogP1.57
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.80
LogP ≤ 51.57
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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Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
The IUPAC name of [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine (CID 103025367) is [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine is COC(C)(C)CC(Cc1c(Cl)c(C)nn1C)NN.
What is the InChIKey of [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
The InChIKey is GTRLJUHRPOUSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23ClN4O/c1-8-11(13)10(17(4)16-8)6-9(15-14)7-12(2,3)18-5/h9,15H,6-7,14H2,1-5H3.
What are the key properties of [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine has a molecular weight of 274.80 g/mol, XLogP of 1.57, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine is sourced from PubChem (CID 103025367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).