[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine

C11H22N4O — CID 105225066

IUPAC[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine
SMILESCOCCCC(Cc1cc(C)nn1C)NN
InChIInChI=1S/C11H22N4O/c1-9-7-11(15(2)14-9)8-10(13-12)5-4-6-16-3/h7,10,13H,4-6,8,12H2,1-3H3
InChIKeyPACGITPIXFDWMV-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.53
Rot. Bonds7

About [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine

[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine (PubChem CID 105225066) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine
PubChem CID105225066
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC Name[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine
SMILESCOCCCC(Cc1cc(C)nn1C)NN
InChIInChI=1S/C11H22N4O/c1-9-7-11(15(2)14-9)8-10(13-12)5-4-6-16-3/h7,10,13H,4-6,8,12H2,1-3H3
InChIKeyPACGITPIXFDWMV-UHFFFAOYSA-N
XLogP0.53
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(2,5-dimethylpyrazol-3-yl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
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[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-yloxypropan-2-yl]hydrazine
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[1-(2,5-dimethylpyrazol-3-yl)-5-thiophen-2-ylpentan-2-yl]hydrazine
CID 105315827
[1-(5-chloro-1,3-dimethylpyrazol-4-yl)-5-methoxypentan-2-yl]hydrazine
CID 105225160
[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
CID 105226150
[1-(2,5-dimethylpyrazol-3-yl)-4-(2-methylphenyl)butan-2-yl]hydrazine
CID 105315719
[1-(2,5-dimethylphenyl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105315883
[1-(2,5-dimethylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
CID 103560494
1-(2,5-dimethylpyrazol-3-yl)-N-methylundecan-2-amine
CID 104996240
[5-methoxy-1-(2-methyltetrazol-5-yl)pentan-2-yl]hydrazine
CID 107066112
[1-(2,5-dimethylpyrazol-3-yl)-4,5,5-trimethylhexan-2-yl]hydrazine
CID 105315889
[1-(2,5-dimethylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
CID 105272137

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine?
The IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine (CID 105225066) is [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine?
The canonical SMILES for [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine is COCCCC(Cc1cc(C)nn1C)NN.
What is the InChIKey of [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine?
The InChIKey is PACGITPIXFDWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-9-7-11(15(2)14-9)8-10(13-12)5-4-6-16-3/h7,10,13H,4-6,8,12H2,1-3H3.
What are the key properties of [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine?
[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine has a molecular weight of 226.32 g/mol, XLogP of 0.53, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine is sourced from PubChem (CID 105225066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).