2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide

C11H23N3O2 — CID 63980111

IUPAC2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide
SMILESCCC(C(=O)NN)N1CCC(COC)CC1
InChIInChI=1S/C11H23N3O2/c1-3-10(11(15)13-12)14-6-4-9(5-7-14)8-16-2/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyLQNQRXSYDIPULO-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.11
Rot. Bonds5

About 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide

2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide (PubChem CID 63980111) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide.

Molecular Properties

Compound Name2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide
PubChem CID63980111
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide
SMILESCCC(C(=O)NN)N1CCC(COC)CC1
InChIInChI=1S/C11H23N3O2/c1-3-10(11(15)13-12)14-6-4-9(5-7-14)8-16-2/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyLQNQRXSYDIPULO-UHFFFAOYSA-N
XLogP0.11
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
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': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-[4-(methoxymethyl)piperidin-1-yl]butanoate
CID 64660664
3-methoxy-2-(4-methylpiperidin-1-yl)propanehydrazide
CID 103229441
3-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide
CID 63980494
2-(4-piperidin-1-ylpiperidin-1-yl)butanehydrazide
CID 63571373
3-methoxy-2-[3-(methoxymethyl)piperidin-1-yl]propanehydrazide
CID 106589687
2-(4-acetylpiperazin-1-yl)butanehydrazide
CID 63568814
2-(3-ethylpiperidin-1-yl)butanehydrazide
CID 63572940
2-[3-(hydroxymethyl)pyrrolidin-1-yl]pentanehydrazide
CID 112629345
methyl 3-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylbutanoate
CID 79414057
2-[4-(2-hydroxyethoxy)piperidin-1-yl]pentanehydrazide
CID 83047550
ethyl 2-(4-methylpiperidin-1-yl)butanoate
CID 64663481
2-(4-benzylpiperidin-1-yl)pentanehydrazide
CID 83052069

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide?
The IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide (CID 63980111) is 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide.
What is the SMILES notation for 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide?
The canonical SMILES for 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide is CCC(C(=O)NN)N1CCC(COC)CC1.
What is the InChIKey of 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide?
The InChIKey is LQNQRXSYDIPULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-3-10(11(15)13-12)14-6-4-9(5-7-14)8-16-2/h9-10H,3-8,12H2,1-2H3,(H,13,15).
What are the key properties of 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide?
2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide has a molecular weight of 229.32 g/mol, XLogP of 0.11, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)piperidin-1-yl]butanehydrazide is sourced from PubChem (CID 63980111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).