3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide

C11H17N3O3 — CID 63570591

IUPAC3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide
SMILESNNC(=O)c1occc1CN1CCC(O)CC1
InChIInChI=1S/C11H17N3O3/c12-13-11(16)10-8(3-6-17-10)7-14-4-1-9(15)2-5-14/h3,6,9,15H,1-2,4-5,7,12H2,(H,13,16)
InChIKeyIEIISYMRYILARG-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.16
Rot. Bonds3

About 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide

3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide (PubChem CID 63570591) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide.

Molecular Properties

Compound Name3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide
PubChem CID63570591
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide
SMILESNNC(=O)c1occc1CN1CCC(O)CC1
InChIInChI=1S/C11H17N3O3/c12-13-11(16)10-8(3-6-17-10)7-14-4-1-9(15)2-5-14/h3,6,9,15H,1-2,4-5,7,12H2,(H,13,16)
InChIKeyIEIISYMRYILARG-UHFFFAOYSA-N
XLogP-0.16
TPSA91.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-[1-[[2-(hydrazinecarbonyl)furan-3-yl]methyl]piperidin-4-yl]acetamide
CID 63578815
3-(piperidin-1-ylmethyl)furan-2-carbohydrazide
CID 63568851
3-[(4-propylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63572820
3-[(4-hydroxy-3-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 114683794
3-[(3,4-dimethylpyrrolidin-1-yl)methyl]furan-2-carbohydrazide
CID 79184345
3-[(3-propoxypiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63578962
3-[(2-ethylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63572129
3-[(3-hydroxy-4-methylpiperidin-1-yl)methyl]furan-2-carboxylic acid
CID 102959446
3-(morpholin-4-ylmethyl)furan-2-carboxylic acid
CID 43153189
N-[[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]-3-(phenoxymethyl)furan-2-carboxamide
CID 56555280
3-[(4-cyclopropylpiperazin-1-yl)methyl]furan-2-carboxylic acid
CID 61441416
3-[(dimethylamino)methyl]furan-2-carbohydrazide
CID 63571555

Frequently Asked Questions

What is the IUPAC name of 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide?
The IUPAC name of 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide (CID 63570591) is 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide.
What is the SMILES notation for 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide?
The canonical SMILES for 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide is NNC(=O)c1occc1CN1CCC(O)CC1.
What is the InChIKey of 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide?
The InChIKey is IEIISYMRYILARG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c12-13-11(16)10-8(3-6-17-10)7-14-4-1-9(15)2-5-14/h3,6,9,15H,1-2,4-5,7,12H2,(H,13,16).
What are the key properties of 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide?
3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide has a molecular weight of 239.27 g/mol, XLogP of -0.16, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide is sourced from PubChem (CID 63570591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).