4-(2-cyanomorpholin-4-yl)butanehydrazide

C9H16N4O2 — CID 79680995

IUPAC4-(2-cyanomorpholin-4-yl)butanehydrazide
SMILESN#CC1CN(CCCC(=O)NN)CCO1
InChIInChI=1S/C9H16N4O2/c10-6-8-7-13(4-5-15-8)3-1-2-9(14)12-11/h8H,1-5,7,11H2,(H,12,14)
InChIKeyHCYOPRQKIJPBBQ-UHFFFAOYSA-N
MW212.25 g/mol
LogP-1.02
Rot. Bonds4

About 4-(2-cyanomorpholin-4-yl)butanehydrazide

4-(2-cyanomorpholin-4-yl)butanehydrazide (PubChem CID 79680995) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-(2-cyanomorpholin-4-yl)butanehydrazide.

Molecular Properties

Compound Name4-(2-cyanomorpholin-4-yl)butanehydrazide
PubChem CID79680995
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name4-(2-cyanomorpholin-4-yl)butanehydrazide
SMILESN#CC1CN(CCCC(=O)NN)CCO1
InChIInChI=1S/C9H16N4O2/c10-6-8-7-13(4-5-15-8)3-1-2-9(14)12-11/h8H,1-5,7,11H2,(H,12,14)
InChIKeyHCYOPRQKIJPBBQ-UHFFFAOYSA-N
XLogP-1.02
TPSA91.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-1.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

2-[4-[(2-cyanomorpholin-4-yl)methyl]phenyl]acetohydrazide
CID 105352027
4-[3-(methylamino)propyl]morpholine-2-carbonitrile
CID 79681736
4-(2-methyl-1,4-oxazepan-4-yl)butanehydrazide
CID 63583172
4-(3-methoxypropyl)morpholine-2-carbonitrile
CID 112734096
4-(2-fluoroethyl)morpholine-2-carbonitrile
CID 80601541
5-morpholin-4-ylpentanehydrazide
CID 63570305
N-(3-aminophenyl)-3-(2-cyanomorpholin-4-yl)propanamide
CID 79665814
4-(3,4-dihydroxypyrrolidin-1-yl)butanehydrazide
CID 106674306
4-[2-(2-methoxyethoxy)ethyl]morpholine-2-carbonitrile
CID 79675052
methyl 3-(2-cyanomorpholin-4-yl)-2-methylpropanoate
CID 79674895
N-(2-amino-5-chlorophenyl)-3-(2-cyanomorpholin-4-yl)propanamide
CID 79663166
4-(3-hydroxypiperidin-1-yl)butanehydrazide
CID 63585558

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyanomorpholin-4-yl)butanehydrazide?
The IUPAC name of 4-(2-cyanomorpholin-4-yl)butanehydrazide (CID 79680995) is 4-(2-cyanomorpholin-4-yl)butanehydrazide.
What is the SMILES notation for 4-(2-cyanomorpholin-4-yl)butanehydrazide?
The canonical SMILES for 4-(2-cyanomorpholin-4-yl)butanehydrazide is N#CC1CN(CCCC(=O)NN)CCO1.
What is the InChIKey of 4-(2-cyanomorpholin-4-yl)butanehydrazide?
The InChIKey is HCYOPRQKIJPBBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c10-6-8-7-13(4-5-15-8)3-1-2-9(14)12-11/h8H,1-5,7,11H2,(H,12,14).
What are the key properties of 4-(2-cyanomorpholin-4-yl)butanehydrazide?
4-(2-cyanomorpholin-4-yl)butanehydrazide has a molecular weight of 212.25 g/mol, XLogP of -1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyanomorpholin-4-yl)butanehydrazide is sourced from PubChem (CID 79680995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).