(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone

C12H18N4O2 — CID 62234119

IUPAC(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
SMILESNNc1ccnc(C(=O)N2CCC(CO)CC2)c1
InChIInChI=1S/C12H18N4O2/c13-15-10-1-4-14-11(7-10)12(18)16-5-2-9(8-17)3-6-16/h1,4,7,9,17H,2-3,5-6,8,13H2,(H,14,15)
InChIKeyLGXUOWBYAZYDSY-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.21
Rot. Bonds3

About (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone

(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone (PubChem CID 62234119) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
PubChem CID62234119
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
SMILESNNc1ccnc(C(=O)N2CCC(CO)CC2)c1
InChIInChI=1S/C12H18N4O2/c13-15-10-1-4-14-11(7-10)12(18)16-5-2-9(8-17)3-6-16/h1,4,7,9,17H,2-3,5-6,8,13H2,(H,14,15)
InChIKeyLGXUOWBYAZYDSY-UHFFFAOYSA-N
XLogP0.21
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 ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
CID 62242778
[4-(hydroxymethyl)piperidin-1-yl]-[4-(methylamino)-2-pyridinyl]methanone
CID 55042246
[4-(hydroxymethyl)piperidin-1-yl]-[4-(propylamino)-2-pyridinyl]methanone
CID 62185374
[4-(dimethylamino)piperidin-1-yl]-(4-hydrazinyl-2-pyridinyl)methanone
CID 62243583
(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
CID 62237509
(3-fluoro-2-hydrazinyl-4-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
CID 105387751
[4-(methylamino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 62171607
[4-(benzylamino)-2-pyridinyl]-(4-benzylpiperidin-1-yl)methanone
CID 109209814
[4-(1-hydroxyethyl)piperidin-1-yl]-[4-(methylamino)-2-pyridinyl]methanone
CID 106837578
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-(4-hydrazinyl-2-pyridinyl)methanone
CID 65322440
[4-(dimethylamino)piperidin-1-yl]-[4-(ethylamino)-2-pyridinyl]methanone
CID 62169404
ethyl 4-[4-(cyclopropylamino)pyridine-2-carbonyl]piperazine-1-carboxylate
CID 109201937

Frequently Asked Questions

What is the IUPAC name of (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone?
The IUPAC name of (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone (CID 62234119) is (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone is NNc1ccnc(C(=O)N2CCC(CO)CC2)c1.
What is the InChIKey of (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone?
The InChIKey is LGXUOWBYAZYDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c13-15-10-1-4-14-11(7-10)12(18)16-5-2-9(8-17)3-6-16/h1,4,7,9,17H,2-3,5-6,8,13H2,(H,14,15).
What are the key properties of (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone?
(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone has a molecular weight of 250.30 g/mol, XLogP of 0.21, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 62234119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).