[1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine

C10H19ClN4O — CID 103025503

IUPAC[1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine
SMILESCOC(C)(C)CC(NN)c1c(Cl)cnn1C
InChIInChI=1S/C10H19ClN4O/c1-10(2,16-4)5-8(14-12)9-7(11)6-13-15(9)3/h6,8,14H,5,12H2,1-4H3
InChIKeyQVPIFSOISAHANB-UHFFFAOYSA-N
MW246.74 g/mol
LogP1.39
Rot. Bonds5

About [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine

[1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine (PubChem CID 103025503) has the molecular formula C10H19ClN4O and a molecular weight of 246.74 g/mol. Its IUPAC name is [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine
PubChem CID103025503
Molecular FormulaC10H19ClN4O
Molecular Weight246.74 g/mol
Exact Mass246.12
IUPAC Name[1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine
SMILESCOC(C)(C)CC(NN)c1c(Cl)cnn1C
InChIInChI=1S/C10H19ClN4O/c1-10(2,16-4)5-8(14-12)9-7(11)6-13-15(9)3/h6,8,14H,5,12H2,1-4H3
InChIKeyQVPIFSOISAHANB-UHFFFAOYSA-N
XLogP1.39
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 51.39
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-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine?
The IUPAC name of [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine (CID 103025503) is [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine is COC(C)(C)CC(NN)c1c(Cl)cnn1C.
What is the InChIKey of [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine?
The InChIKey is QVPIFSOISAHANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClN4O/c1-10(2,16-4)5-8(14-12)9-7(11)6-13-15(9)3/h6,8,14H,5,12H2,1-4H3.
What are the key properties of [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine?
[1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine has a molecular weight of 246.74 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-1-methylpyrazol-5-yl)-3-methoxy-3-methylbutyl]hydrazine is sourced from PubChem (CID 103025503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).