(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone

C13H20N4O — CID 62242778

IUPAC(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
SMILESCCC1CCN(C(=O)c2cc(NN)ccn2)CC1
InChIInChI=1S/C13H20N4O/c1-2-10-4-7-17(8-5-10)13(18)12-9-11(16-14)3-6-15-12/h3,6,9-10H,2,4-5,7-8,14H2,1H3,(H,15,16)
InChIKeyJECGZFUZWJGUCM-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.63
Rot. Bonds3

About (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone

(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone (PubChem CID 62242778) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone.

Molecular Properties

Compound Name(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
PubChem CID62242778
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
SMILESCCC1CCN(C(=O)c2cc(NN)ccn2)CC1
InChIInChI=1S/C13H20N4O/c1-2-10-4-7-17(8-5-10)13(18)12-9-11(16-14)3-6-15-12/h3,6,9-10H,2,4-5,7-8,14H2,1H3,(H,15,16)
InChIKeyJECGZFUZWJGUCM-UHFFFAOYSA-N
XLogP1.63
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.63
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-hydrazinyl-2-pyridinyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
CID 62234119
[4-(dimethylamino)piperidin-1-yl]-(4-hydrazinyl-2-pyridinyl)methanone
CID 62243583
(4-tert-butylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone
CID 62237509
[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-(ethylamino)-2-pyridinyl]methanone
CID 62169404
[4-(methylamino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 62171607
ethyl 4-[4-(cyclopropylamino)pyridine-2-carbonyl]piperazine-1-carboxylate
CID 109201937
[4-(1-hydroxyethyl)piperidin-1-yl]-[4-(methylamino)-2-pyridinyl]methanone
CID 106837578
N-[(1-ethylpyrrolidin-3-yl)methyl]-4-hydrazinylpyridine-2-carboxamide
CID 62237077
[4-(3,4-dimethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109205154
[4-(benzylamino)-2-pyridinyl]-(4-benzylpiperidin-1-yl)methanone
CID 109209814

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
The IUPAC name of (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone (CID 62242778) is (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone.
What is the SMILES notation for (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
The canonical SMILES for (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone is CCC1CCN(C(=O)c2cc(NN)ccn2)CC1.
What is the InChIKey of (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
The InChIKey is JECGZFUZWJGUCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-10-4-7-17(8-5-10)13(18)12-9-11(16-14)3-6-15-12/h3,6,9-10H,2,4-5,7-8,14H2,1H3,(H,15,16).
What are the key properties of (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone?
(4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone has a molecular weight of 248.33 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperidin-1-yl)-(4-hydrazinyl-2-pyridinyl)methanone is sourced from PubChem (CID 62242778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).