(3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone

C14H22N4O2 — CID 113379218

IUPAC(3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone
SMILESCCOC1CCCN(C(=O)c2cc(C)nc(NN)c2)C1
InChIInChI=1S/C14H22N4O2/c1-3-20-12-5-4-6-18(9-12)14(19)11-7-10(2)16-13(8-11)17-15/h7-8,12H,3-6,9,15H2,1-2H3,(H,16,17)
InChIKeyWGRGTDSOIQNISE-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.32
Rot. Bonds4

About (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone

(3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone (PubChem CID 113379218) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone.

Molecular Properties

Compound Name(3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone
PubChem CID113379218
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name(3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone
SMILESCCOC1CCCN(C(=O)c2cc(C)nc(NN)c2)C1
InChIInChI=1S/C14H22N4O2/c1-3-20-12-5-4-6-18(9-12)14(19)11-7-10(2)16-13(8-11)17-15/h7-8,12H,3-6,9,15H2,1-2H3,(H,16,17)
InChIKeyWGRGTDSOIQNISE-UHFFFAOYSA-N
XLogP1.32
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.32
H-Bond Donors ≤ 52
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

(3,5-dihydroxyphenyl)-(3-ethoxypiperidin-1-yl)methanone
CID 103892247
(2-hydrazinyl-6-methyl-4-pyridinyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 114799971
[4-(aminomethyl)phenyl]-(3-ethoxypiperidin-1-yl)methanone
CID 54985369
(2-chloro-6-hydrazinyl-4-pyridinyl)-(3-methylpiperidin-1-yl)methanone
CID 62247185
(2-hydrazinyl-6-methyl-4-pyridinyl)-morpholin-4-ylmethanone
CID 70843948
(3-ethoxypiperidin-1-yl)-quinoxalin-6-ylmethanone
CID 16734283
(3,5-diaminophenyl)-(3-propoxypiperidin-1-yl)methanone
CID 61168973
(3-chlorophenyl)-(3-ethoxypiperidin-1-yl)methanone
CID 42656405
(3-ethoxypiperidin-1-yl)-[6-(methylamino)-2-pyridinyl]methanone
CID 62233605
4-(3-ethoxypiperidine-1-carbonyl)-1-methylpyridin-2-one
CID 47736704
(3-ethoxypiperidin-1-yl)-(2-methylphenyl)methanone
CID 42656402
(3-ethoxypiperidin-1-yl)-(2-hydroxy-4-methylphenyl)methanone
CID 54983413

Frequently Asked Questions

What is the IUPAC name of (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone?
The IUPAC name of (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone (CID 113379218) is (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone.
What is the SMILES notation for (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone?
The canonical SMILES for (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone is CCOC1CCCN(C(=O)c2cc(C)nc(NN)c2)C1.
What is the InChIKey of (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone?
The InChIKey is WGRGTDSOIQNISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-3-20-12-5-4-6-18(9-12)14(19)11-7-10(2)16-13(8-11)17-15/h7-8,12H,3-6,9,15H2,1-2H3,(H,16,17).
What are the key properties of (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone?
(3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone has a molecular weight of 278.36 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxypiperidin-1-yl)-(2-hydrazinyl-6-methyl-4-pyridinyl)methanone is sourced from PubChem (CID 113379218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).