[6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine

C16H30N4O — CID 105314157

IUPAC[6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine
SMILESCc1nn(C)c(C)c1CCC(CCCC1CCCO1)NN
InChIInChI=1S/C16H30N4O/c1-12-16(13(2)20(3)19-12)10-9-14(18-17)6-4-7-15-8-5-11-21-15/h14-15,18H,4-11,17H2,1-3H3
InChIKeyRAJVYZFCMVFCRM-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.15
Rot. Bonds8

About [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine

[6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine (PubChem CID 105314157) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine.

Molecular Properties

Compound Name[6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine
PubChem CID105314157
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name[6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine
SMILESCc1nn(C)c(C)c1CCC(CCCC1CCCO1)NN
InChIInChI=1S/C16H30N4O/c1-12-16(13(2)20(3)19-12)10-9-14(18-17)6-4-7-15-8-5-11-21-15/h14-15,18H,4-11,17H2,1-3H3
InChIKeyRAJVYZFCMVFCRM-UHFFFAOYSA-N
XLogP2.15
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.15
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 [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine?
The IUPAC name of [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine (CID 105314157) is [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine.
What is the SMILES notation for [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine?
The canonical SMILES for [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine is Cc1nn(C)c(C)c1CCC(CCCC1CCCO1)NN.
What is the InChIKey of [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine?
The InChIKey is RAJVYZFCMVFCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-12-16(13(2)20(3)19-12)10-9-14(18-17)6-4-7-15-8-5-11-21-15/h14-15,18H,4-11,17H2,1-3H3.
What are the key properties of [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine?
[6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine has a molecular weight of 294.44 g/mol, XLogP of 2.15, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)hexan-3-yl]hydrazine is sourced from PubChem (CID 105314157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).