3-methoxy-2-[methyl(pentyl)amino]propanehydrazide

C10H23N3O2 — CID 103229503

IUPAC3-methoxy-2-[methyl(pentyl)amino]propanehydrazide
SMILESCCCCCN(C)C(COC)C(=O)NN
InChIInChI=1S/C10H23N3O2/c1-4-5-6-7-13(2)9(8-15-3)10(14)12-11/h9H,4-8,11H2,1-3H3,(H,12,14)
InChIKeyYETHRQXMBSHQOZ-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.11
Rot. Bonds8

About 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide

3-methoxy-2-[methyl(pentyl)amino]propanehydrazide (PubChem CID 103229503) has the molecular formula C10H23N3O2 and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide.

Molecular Properties

Compound Name3-methoxy-2-[methyl(pentyl)amino]propanehydrazide
PubChem CID103229503
Molecular FormulaC10H23N3O2
Molecular Weight217.31 g/mol
Exact Mass217.18
IUPAC Name3-methoxy-2-[methyl(pentyl)amino]propanehydrazide
SMILESCCCCCN(C)C(COC)C(=O)NN
InChIInChI=1S/C10H23N3O2/c1-4-5-6-7-13(2)9(8-15-3)10(14)12-11/h9H,4-8,11H2,1-3H3,(H,12,14)
InChIKeyYETHRQXMBSHQOZ-UHFFFAOYSA-N
XLogP0.11
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.11
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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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide?
The IUPAC name of 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide (CID 103229503) is 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide.
What is the SMILES notation for 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide?
The canonical SMILES for 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide is CCCCCN(C)C(COC)C(=O)NN.
What is the InChIKey of 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide?
The InChIKey is YETHRQXMBSHQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2/c1-4-5-6-7-13(2)9(8-15-3)10(14)12-11/h9H,4-8,11H2,1-3H3,(H,12,14).
What are the key properties of 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide?
3-methoxy-2-[methyl(pentyl)amino]propanehydrazide has a molecular weight of 217.31 g/mol, XLogP of 0.11, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[methyl(pentyl)amino]propanehydrazide is sourced from PubChem (CID 103229503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).