5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine

C16H37N3O2 — CID 138726341

IUPAC5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine
SMILESCC(CC(C)(C)OCCOCC(C)(C)CC(C)(C)N)NN
InChIInChI=1S/C16H37N3O2/c1-13(19-18)10-16(6,7)21-9-8-20-12-14(2,3)11-15(4,5)17/h13,19H,8-12,17-18H2,1-7H3
InChIKeyCSAXIWZJASTFBC-UHFFFAOYSA-N
MW303.49 g/mol
LogP2.19
Rot. Bonds11

About 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine

5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine (PubChem CID 138726341) has the molecular formula C16H37N3O2 and a molecular weight of 303.49 g/mol. Its IUPAC name is 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine.

Molecular Properties

Compound Name5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine
PubChem CID138726341
Molecular FormulaC16H37N3O2
Molecular Weight303.49 g/mol
Exact Mass303.29
IUPAC Name5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine
SMILESCC(CC(C)(C)OCCOCC(C)(C)CC(C)(C)N)NN
InChIInChI=1S/C16H37N3O2/c1-13(19-18)10-16(6,7)21-9-8-20-12-14(2,3)11-15(4,5)17/h13,19H,8-12,17-18H2,1-7H3
InChIKeyCSAXIWZJASTFBC-UHFFFAOYSA-N
XLogP2.19
TPSA82.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.49
LogP ≤ 52.19
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine?
The IUPAC name of 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine (CID 138726341) is 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine.
What is the SMILES notation for 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine?
The canonical SMILES for 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine is CC(CC(C)(C)OCCOCC(C)(C)CC(C)(C)N)NN.
What is the InChIKey of 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine?
The InChIKey is CSAXIWZJASTFBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H37N3O2/c1-13(19-18)10-16(6,7)21-9-8-20-12-14(2,3)11-15(4,5)17/h13,19H,8-12,17-18H2,1-7H3.
What are the key properties of 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine?
5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine has a molecular weight of 303.49 g/mol, XLogP of 2.19, 11 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-hydrazinyl-2-methylpentan-2-yl)oxyethoxy]-2,4,4-trimethylpentan-2-amine is sourced from PubChem (CID 138726341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).