[(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine

C16H26N2O2 — CID 105256191

IUPAC[(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1cccc(C(NN)C2(C)CCCCO2)c1
InChIInChI=1S/C16H26N2O2/c1-12(2)20-14-8-6-7-13(11-14)15(18-17)16(3)9-4-5-10-19-16/h6-8,11-12,15,18H,4-5,9-10,17H2,1-3H3
InChIKeyFUBBTBAGVRUMSQ-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.94
Rot. Bonds5

About [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine

[(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine (PubChem CID 105256191) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
PubChem CID105256191
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name[(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1cccc(C(NN)C2(C)CCCCO2)c1
InChIInChI=1S/C16H26N2O2/c1-12(2)20-14-8-6-7-13(11-14)15(18-17)16(3)9-4-5-10-19-16/h6-8,11-12,15,18H,4-5,9-10,17H2,1-3H3
InChIKeyFUBBTBAGVRUMSQ-UHFFFAOYSA-N
XLogP2.94
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
The IUPAC name of [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine (CID 105256191) is [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine is CC(C)Oc1cccc(C(NN)C2(C)CCCCO2)c1.
What is the InChIKey of [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
The InChIKey is FUBBTBAGVRUMSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-12(2)20-14-8-6-7-13(11-14)15(18-17)16(3)9-4-5-10-19-16/h6-8,11-12,15,18H,4-5,9-10,17H2,1-3H3.
What are the key properties of [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
[(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine has a molecular weight of 278.40 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methyloxan-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105256191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).