(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone

C15H24N4O — CID 62237509

IUPAC(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
SMILESCC(C)(C)C1CCN(C(=O)c2cc(NN)ccn2)CC1
InChIInChI=1S/C15H24N4O/c1-15(2,3)11-5-8-19(9-6-11)14(20)13-10-12(18-16)4-7-17-13/h4,7,10-11H,5-6,8-9,16H2,1-3H3,(H,17,18)
InChIKeyXNUJJUTVKPAJOA-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.27
Rot. Bonds2

About (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone

(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone (PubChem CID 62237509) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone.

Molecular Properties

Compound Name(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
PubChem CID62237509
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
SMILESCC(C)(C)C1CCN(C(=O)c2cc(NN)ccn2)CC1
InChIInChI=1S/C15H24N4O/c1-15(2,3)11-5-8-19(9-6-11)14(20)13-10-12(18-16)4-7-17-13/h4,7,10-11H,5-6,8-9,16H2,1-3H3,(H,17,18)
InChIKeyXNUJJUTVKPAJOA-UHFFFAOYSA-N
XLogP2.27
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(dimethylamino)piperidin-1-yl]-(4-hydrazinyl-2-pyridinyl)methanone
CID 62243583
(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
CID 62242778
(4-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
CID 62234119
2-(4-tert-butylazepane-1-carbonyl)pyridine-4-carboxylic acid
CID 122055710
[4-(methylamino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 62171607
[4-(hydroxymethyl)piperidin-1-yl]-[4-(methylamino)-2-pyridinyl]methanone
CID 55042246
[4-(1-hydroxyethyl)piperidin-1-yl]-[4-(methylamino)-2-pyridinyl]methanone
CID 106837578
[4-(dimethylamino)piperidin-1-yl]-[4-(ethylamino)-2-pyridinyl]methanone
CID 62169404
(4,4-dimethylpiperidin-1-yl)-[4-(methylamino)-2-pyridinyl]methanone
CID 62930528
azepan-1-yl-[4-(tert-butylamino)-2-pyridinyl]methanone
CID 109216956
(6-aminopyridazin-3-yl)-(4-tert-butylpiperidin-1-yl)methanone
CID 55042129
(4-hydroxy-3-methylpiperidin-1-yl)-[4-(methylamino)-2-pyridinyl]methanone
CID 114681646

Frequently Asked Questions

What is the IUPAC name of (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
The IUPAC name of (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone (CID 62237509) is (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone.
What is the SMILES notation for (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
The canonical SMILES for (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone is CC(C)(C)C1CCN(C(=O)c2cc(NN)ccn2)CC1.
What is the InChIKey of (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
The InChIKey is XNUJJUTVKPAJOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-15(2,3)11-5-8-19(9-6-11)14(20)13-10-12(18-16)4-7-17-13/h4,7,10-11H,5-6,8-9,16H2,1-3H3,(H,17,18).
What are the key properties of (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone has a molecular weight of 276.38 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone is sourced from PubChem (CID 62237509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).