(4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone

C14H21N3O2 — CID 106588870

IUPAC(4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
SMILESCOCC1CCCN(C(=O)c2ccc(NN)cc2)C1
InChIInChI=1S/C14H21N3O2/c1-19-10-11-3-2-8-17(9-11)14(18)12-4-6-13(16-15)7-5-12/h4-7,11,16H,2-3,8-10,15H2,1H3
InChIKeyKOKXTFDZJCZFSB-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.47
Rot. Bonds4

About (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone

(4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone (PubChem CID 106588870) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
PubChem CID106588870
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name(4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
SMILESCOCC1CCCN(C(=O)c2ccc(NN)cc2)C1
InChIInChI=1S/C14H21N3O2/c1-19-10-11-3-2-8-17(9-11)14(18)12-4-6-13(16-15)7-5-12/h4-7,11,16H,2-3,8-10,15H2,1H3
InChIKeyKOKXTFDZJCZFSB-UHFFFAOYSA-N
XLogP1.47
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.47
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'}

Analyze (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-(methoxymethyl)piperidin-1-yl]-(4-methylphenyl)methanone
CID 90504931
(3,5-difluoro-4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106588873
(3-amino-4-methoxyphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106585621
[3-(methoxymethyl)pyrrolidin-1-yl]-[4-(propylamino)phenyl]methanone
CID 64583564
[3-(methoxymethyl)piperidin-1-yl]-[3-methyl-4-(methylamino)phenyl]methanone
CID 106588810
(4-bromo-3-methylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 113339183
[(3R)-3-(methoxymethyl)piperidin-1-yl]-[6-[4-(methoxymethyl)piperidin-1-yl]-3-pyridinyl]methanone
CID 28957540
[3-(methoxymethyl)piperidin-1-yl]-(6-morpholin-4-yl-3-pyridinyl)methanone
CID 45232737
(4-bromo-3-chlorophenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 113259178
(3-bromo-4-chlorophenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 103841992
1H-indol-6-yl-[(3R)-3-(methoxymethyl)piperidin-1-yl]methanone
CID 94658936
1H-indol-6-yl-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 56724316

Frequently Asked Questions

What is the IUPAC name of (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone?
The IUPAC name of (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone (CID 106588870) is (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone is COCC1CCCN(C(=O)c2ccc(NN)cc2)C1.
What is the InChIKey of (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone?
The InChIKey is KOKXTFDZJCZFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-19-10-11-3-2-8-17(9-11)14(18)12-4-6-13(16-15)7-5-12/h4-7,11,16H,2-3,8-10,15H2,1H3.
What are the key properties of (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone?
(4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone has a molecular weight of 263.34 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydrazinylphenyl)-[3-(methoxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 106588870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).