2-(morpholin-4-ylmethyl)benzohydrazide

C12H17N3O2 — CID 28985199

IUPAC2-(morpholin-4-ylmethyl)benzohydrazide
SMILESNNC(=O)c1ccccc1CN1CCOCC1
InChIInChI=1S/C12H17N3O2/c13-14-12(16)11-4-2-1-3-10(11)9-15-5-7-17-8-6-15/h1-4H,5-9,13H2,(H,14,16)
InChIKeyCDUHCWGQGOOCGV-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.12
Rot. Bonds3

About 2-(morpholin-4-ylmethyl)benzohydrazide

2-(morpholin-4-ylmethyl)benzohydrazide (PubChem CID 28985199) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-(morpholin-4-ylmethyl)benzohydrazide.

Molecular Properties

Compound Name2-(morpholin-4-ylmethyl)benzohydrazide
PubChem CID28985199
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name2-(morpholin-4-ylmethyl)benzohydrazide
SMILESNNC(=O)c1ccccc1CN1CCOCC1
InChIInChI=1S/C12H17N3O2/c13-14-12(16)11-4-2-1-3-10(11)9-15-5-7-17-8-6-15/h1-4H,5-9,13H2,(H,14,16)
InChIKeyCDUHCWGQGOOCGV-UHFFFAOYSA-N
XLogP0.12
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-(morpholin-4-ylmethyl)benzamide
CID 83387497
CID 131887032
CID 131887032
2-[(4-acetylpiperazin-1-yl)methyl]benzohydrazide
CID 63569716
2-(1,3-dihydroisoindol-2-ylmethyl)benzohydrazide
CID 63573353
2-[(4,4-dimethylpiperidin-1-yl)methyl]benzohydrazide
CID 63573428
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)benzohydrazide
CID 66371242
2-morpholin-4-ylbenzohydrazide
CID 7148386
(2S)-2-[[2-(morpholin-4-ylmethyl)benzoyl]amino]hexanoic acid
CID 120614385
2-[[4-(2-hydroxyethoxy)piperidin-1-yl]methyl]benzohydrazide
CID 82689559
2-[[3-(hydroxymethyl)pyrrolidin-1-yl]methyl]benzohydrazide
CID 112629323
2-[(3-oxo-1,4-diazepan-1-yl)methyl]benzohydrazide
CID 65366363
(4-acetamidophenyl) 2-(morpholin-4-ylmethyl)benzoate
CID 14857757

Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-4-ylmethyl)benzohydrazide?
The IUPAC name of 2-(morpholin-4-ylmethyl)benzohydrazide (CID 28985199) is 2-(morpholin-4-ylmethyl)benzohydrazide.
What is the SMILES notation for 2-(morpholin-4-ylmethyl)benzohydrazide?
The canonical SMILES for 2-(morpholin-4-ylmethyl)benzohydrazide is NNC(=O)c1ccccc1CN1CCOCC1.
What is the InChIKey of 2-(morpholin-4-ylmethyl)benzohydrazide?
The InChIKey is CDUHCWGQGOOCGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c13-14-12(16)11-4-2-1-3-10(11)9-15-5-7-17-8-6-15/h1-4H,5-9,13H2,(H,14,16).
What are the key properties of 2-(morpholin-4-ylmethyl)benzohydrazide?
2-(morpholin-4-ylmethyl)benzohydrazide has a molecular weight of 235.29 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-4-ylmethyl)benzohydrazide is sourced from PubChem (CID 28985199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).