6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide

C12H27N3O2 — CID 82965230

IUPAC6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide
SMILESCOCCN(CCCCCC(=O)NN)C(C)C
InChIInChI=1S/C12H27N3O2/c1-11(2)15(9-10-17-3)8-6-4-5-7-12(16)14-13/h11H,4-10,13H2,1-3H3,(H,14,16)
InChIKeyJCIYMZMYYKDZRM-UHFFFAOYSA-N
MW245.37 g/mol
LogP0.89
Rot. Bonds10

About 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide

6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide (PubChem CID 82965230) has the molecular formula C12H27N3O2 and a molecular weight of 245.37 g/mol. Its IUPAC name is 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide.

Molecular Properties

Compound Name6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide
PubChem CID82965230
Molecular FormulaC12H27N3O2
Molecular Weight245.37 g/mol
Exact Mass245.21
IUPAC Name6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide
SMILESCOCCN(CCCCCC(=O)NN)C(C)C
InChIInChI=1S/C12H27N3O2/c1-11(2)15(9-10-17-3)8-6-4-5-7-12(16)14-13/h11H,4-10,13H2,1-3H3,(H,14,16)
InChIKeyJCIYMZMYYKDZRM-UHFFFAOYSA-N
XLogP0.89
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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

5-[pentyl(propan-2-yl)amino]pentanehydrazide
CID 55214628
5-[2-methoxyethyl(2-methylpropyl)amino]pentanehydrazide
CID 63584308
4-[2-methoxyethyl(3-methoxypropyl)amino]pentanehydrazide
CID 63584376
4-[ethyl(propan-2-yl)amino]butanehydrazide
CID 63573828
3-[4-methoxybutyl(propan-2-yl)amino]propanoic acid
CID 104648419
5-[2-methoxyethyl(propan-2-yl)amino]pentanethioamide
CID 82951100
4-[ethyl(2-methoxyethyl)amino]butanehydrazide
CID 63584044
6-[2-(3-methoxypropoxy)ethoxy]hexanehydrazide
CID 103175984
3-methoxy-N-(2-methoxyethyl)-N-propan-2-ylpropan-1-amine
CID 177187385
3-[2-methoxyethyl(3-methoxypropyl)amino]propanehydrazide
CID 63582905
5-chloro-N-(2-methoxyethyl)-N-propan-2-ylpentan-1-amine
CID 82960772
N'-(2-methoxyethyl)-N'-propan-2-ylpropane-1,3-diamine
CID 43137377

Frequently Asked Questions

What is the IUPAC name of 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide?
The IUPAC name of 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide (CID 82965230) is 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide.
What is the SMILES notation for 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide?
The canonical SMILES for 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide is COCCN(CCCCCC(=O)NN)C(C)C.
What is the InChIKey of 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide?
The InChIKey is JCIYMZMYYKDZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2/c1-11(2)15(9-10-17-3)8-6-4-5-7-12(16)14-13/h11H,4-10,13H2,1-3H3,(H,14,16).
What are the key properties of 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide?
6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide has a molecular weight of 245.37 g/mol, XLogP of 0.89, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-methoxyethyl(propan-2-yl)amino]hexanehydrazide is sourced from PubChem (CID 82965230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).