3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide

C10H21N3O2 — CID 63570764

IUPAC3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide
SMILESCC(CN1CCC(CO)CC1)C(=O)NN
InChIInChI=1S/C10H21N3O2/c1-8(10(15)12-11)6-13-4-2-9(7-14)3-5-13/h8-9,14H,2-7,11H2,1H3,(H,12,15)
InChIKeyORPHSKYGUPSZHD-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.68
Rot. Bonds4

About 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide

3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide (PubChem CID 63570764) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide.

Molecular Properties

Compound Name3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide
PubChem CID63570764
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide
SMILESCC(CN1CCC(CO)CC1)C(=O)NN
InChIInChI=1S/C10H21N3O2/c1-8(10(15)12-11)6-13-4-2-9(7-14)3-5-13/h8-9,14H,2-7,11H2,1H3,(H,12,15)
InChIKeyORPHSKYGUPSZHD-UHFFFAOYSA-N
XLogP-0.68
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.68
H-Bond Donors ≤ 53
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

3-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-2-methylpropanehydrazide
CID 114801954
3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanoic acid
CID 43538757
3-(azetidin-1-yl)-2-methylpropanehydrazide
CID 130548534
3-(4-benzylpiperidin-1-yl)-2-methylpropanehydrazide
CID 63573249
[1-[(2S)-2-aminopropyl]piperidin-4-yl]methanol
CID 22689432
benzyl 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanoate
CID 106484236
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropanehydrazide
CID 104961276
[1-[2-(aminomethyl)-3-methylbutyl]piperidin-4-yl]methanol
CID 107443355
3-(3,3-difluoropyrrolidin-1-yl)-2-methylpropanehydrazide
CID 130632039
3-(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-2-methylpropanehydrazide
CID 81115710
methyl 2-acetamido-3-[3-(hydroxymethyl)pyrrolidin-1-yl]propanoate
CID 112626135
2-[3-(hydroxymethyl)pyrrolidin-1-yl]pentanehydrazide
CID 112629345

Frequently Asked Questions

What is the IUPAC name of 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide?
The IUPAC name of 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide (CID 63570764) is 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide.
What is the SMILES notation for 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide?
The canonical SMILES for 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide is CC(CN1CCC(CO)CC1)C(=O)NN.
What is the InChIKey of 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide?
The InChIKey is ORPHSKYGUPSZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-8(10(15)12-11)6-13-4-2-9(7-14)3-5-13/h8-9,14H,2-7,11H2,1H3,(H,12,15).
What are the key properties of 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide?
3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide has a molecular weight of 215.30 g/mol, XLogP of -0.68, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide is sourced from PubChem (CID 63570764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).