2-(2-cyanomorpholin-4-yl)propanehydrazide

C8H14N4O2 — CID 79680453

IUPAC2-(2-cyanomorpholin-4-yl)propanehydrazide
SMILESCC(C(=O)NN)N1CCOC(C#N)C1
InChIInChI=1S/C8H14N4O2/c1-6(8(13)11-10)12-2-3-14-7(4-9)5-12/h6-7H,2-3,5,10H2,1H3,(H,11,13)
InChIKeyYGMDGMWCCUMBHW-UHFFFAOYSA-N
MW198.23 g/mol
LogP-1.41
Rot. Bonds2

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

2-(2-cyanomorpholin-4-yl)propanehydrazide (PubChem CID 79680453) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-(2-cyanomorpholin-4-yl)propanehydrazide.

Molecular Properties

Compound Name2-(2-cyanomorpholin-4-yl)propanehydrazide
PubChem CID79680453
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name2-(2-cyanomorpholin-4-yl)propanehydrazide
SMILESCC(C(=O)NN)N1CCOC(C#N)C1
InChIInChI=1S/C8H14N4O2/c1-6(8(13)11-10)12-2-3-14-7(4-9)5-12/h6-7H,2-3,5,10H2,1H3,(H,11,13)
InChIKeyYGMDGMWCCUMBHW-UHFFFAOYSA-N
XLogP-1.41
TPSA91.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-1.41
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-(2-cyanomorpholin-4-yl)-N-(2-methylpropyl)propanamide
CID 78946325
N-(3-amino-4-chlorophenyl)-2-(2-cyanomorpholin-4-yl)propanamide
CID 79669975
2-(3-cyanopiperidin-1-yl)propanehydrazide
CID 164653332
2-(6-hydroxy-1,4-oxazepan-4-yl)propanehydrazide
CID 131000958
4-[1-(4-ethylphenyl)-1-oxopropan-2-yl]morpholine-2-carbonitrile
CID 79674302
methyl 3-(2-cyanomorpholin-4-yl)-2-methylpropanoate
CID 79674895
2-[2-(aminomethyl)morpholin-4-yl]-N-propan-2-ylpropanamide
CID 61338185
2-cyano-N-propan-2-ylmorpholine-4-carboxamide
CID 78946088
3-(2-ethylmorpholin-4-yl)-2-methylbutanehydrazide
CID 79408999
2-[2-(aminomethyl)morpholin-4-yl]-N-cyclopropylpropanamide
CID 61338383
4-[(2S)-2-amino-3-methylbutanoyl]morpholine-2-carbonitrile
CID 79681377
4-(2-cyanomorpholin-4-yl)butanehydrazide
CID 79680995

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanomorpholin-4-yl)propanehydrazide?
The IUPAC name of 2-(2-cyanomorpholin-4-yl)propanehydrazide (CID 79680453) is 2-(2-cyanomorpholin-4-yl)propanehydrazide.
What is the SMILES notation for 2-(2-cyanomorpholin-4-yl)propanehydrazide?
The canonical SMILES for 2-(2-cyanomorpholin-4-yl)propanehydrazide is CC(C(=O)NN)N1CCOC(C#N)C1.
What is the InChIKey of 2-(2-cyanomorpholin-4-yl)propanehydrazide?
The InChIKey is YGMDGMWCCUMBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-6(8(13)11-10)12-2-3-14-7(4-9)5-12/h6-7H,2-3,5,10H2,1H3,(H,11,13).
What are the key properties of 2-(2-cyanomorpholin-4-yl)propanehydrazide?
2-(2-cyanomorpholin-4-yl)propanehydrazide has a molecular weight of 198.23 g/mol, XLogP of -1.41, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanomorpholin-4-yl)propanehydrazide is sourced from PubChem (CID 79680453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).