6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide

C12H18N4O2 — CID 106909004

IUPAC6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide
SMILESNNC(=O)c1cccc(CN2CCC(O)CC2)n1
InChIInChI=1S/C12H18N4O2/c13-15-12(18)11-3-1-2-9(14-11)8-16-6-4-10(17)5-7-16/h1-3,10,17H,4-8,13H2,(H,15,18)
InChIKeyXARQWJQDQZXETQ-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.36
Rot. Bonds3

About 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide

6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide (PubChem CID 106909004) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide
PubChem CID106909004
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide
SMILESNNC(=O)c1cccc(CN2CCC(O)CC2)n1
InChIInChI=1S/C12H18N4O2/c13-15-12(18)11-3-1-2-9(14-11)8-16-6-4-10(17)5-7-16/h1-3,10,17H,4-8,13H2,(H,15,18)
InChIKeyXARQWJQDQZXETQ-UHFFFAOYSA-N
XLogP-0.36
TPSA91.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.36
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

6-[(3-hydroxypyrrolidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909097
6-[(3-aminopyrrolidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909083
N-[1-[[6-(hydrazinecarbonyl)-2-pyridinyl]methyl]piperidin-4-yl]acetamide
CID 106909367
6-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]pyridine-2-carbohydrazide
CID 106908998
6-[(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)methyl]pyridine-2-carbohydrazide
CID 106909365
6-[(3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909015
6-[(4-butan-2-ylpiperazin-1-yl)methyl]pyridine-2-carbohydrazide
CID 106909093
methyl 6-[[4-(aminomethyl)piperidin-1-yl]methyl]pyridine-2-carboxylate
CID 106905061
6-(piperidin-1-ylmethyl)pyridine-2-carboxamide
CID 66911251
6-[(4-methoxypiperidin-1-yl)methyl]pyridine-2-carboxylic acid
CID 106903971
6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]pyridine-2-carbohydrazide
CID 107395824
6-(pyrrolidin-1-ylmethyl)pyridine-2-carboxylic acid;dihydrochloride
CID 56773487

Frequently Asked Questions

What is the IUPAC name of 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide (CID 106909004) is 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide is NNC(=O)c1cccc(CN2CCC(O)CC2)n1.
What is the InChIKey of 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
The InChIKey is XARQWJQDQZXETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c13-15-12(18)11-3-1-2-9(14-11)8-16-6-4-10(17)5-7-16/h1-3,10,17H,4-8,13H2,(H,15,18).
What are the key properties of 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide?
6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide has a molecular weight of 250.30 g/mol, XLogP of -0.36, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-hydroxypiperidin-1-yl)methyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 106909004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).