5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide

C10H13N3O4 — CID 79468557

IUPAC5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide
SMILESNNC(=O)c1ccc(CN2CCOCC2=O)o1
InChIInChI=1S/C10H13N3O4/c11-12-10(15)8-2-1-7(17-8)5-13-3-4-16-6-9(13)14/h1-2H,3-6,11H2,(H,12,15)
InChIKeyAYYXZQGJWYUSNX-UHFFFAOYSA-N
MW239.23 g/mol
LogP-0.76
Rot. Bonds3

About 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide

5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide (PubChem CID 79468557) has the molecular formula C10H13N3O4 and a molecular weight of 239.23 g/mol. Its IUPAC name is 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide.

Molecular Properties

Compound Name5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide
PubChem CID79468557
Molecular FormulaC10H13N3O4
Molecular Weight239.23 g/mol
Exact Mass239.09
IUPAC Name5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide
SMILESNNC(=O)c1ccc(CN2CCOCC2=O)o1
InChIInChI=1S/C10H13N3O4/c11-12-10(15)8-2-1-7(17-8)5-13-3-4-16-6-9(13)14/h1-2H,3-6,11H2,(H,12,15)
InChIKeyAYYXZQGJWYUSNX-UHFFFAOYSA-N
XLogP-0.76
TPSA97.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 5-0.76
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

5-[(2-oxoazocan-1-yl)methyl]furan-2-carbohydrazide
CID 55214250
2-amino-5-[(3-oxomorpholin-4-yl)methyl]benzoic acid
CID 174520823
5-[(2,5-dioxo-4-propylpiperazin-1-yl)methyl]furan-2-carbohydrazide
CID 79937009
4-[[4-(aminomethyl)phenyl]methyl]morpholin-3-one
CID 79468522
2-[(3-oxomorpholin-4-yl)methyl]furan-3-carbohydrazide
CID 79469519
5-[(3,5-dioxomorpholin-4-yl)methyl]furan-2-carboxylic acid
CID 61313696
5-[(4,4-dimethylpiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 55213258
[4-[(3-oxomorpholin-4-yl)methyl]phenyl]boronic acid
CID 155710289
5-[(4-propylpiperazin-1-yl)methyl]furan-2-carbohydrazide
CID 55214583
5-[(1,3-dioxoisoindol-2-yl)methyl]furan-2-carbohydrazide
CID 63572812
5-[(4-cyclopropylpiperazin-1-yl)methyl]furan-2-carbohydrazide
CID 63577895
5-methyl-4-[(3-oxomorpholin-4-yl)methyl]furan-2-carboxylic acid
CID 79468797

Frequently Asked Questions

What is the IUPAC name of 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide?
The IUPAC name of 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide (CID 79468557) is 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide.
What is the SMILES notation for 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide?
The canonical SMILES for 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide is NNC(=O)c1ccc(CN2CCOCC2=O)o1.
What is the InChIKey of 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide?
The InChIKey is AYYXZQGJWYUSNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O4/c11-12-10(15)8-2-1-7(17-8)5-13-3-4-16-6-9(13)14/h1-2H,3-6,11H2,(H,12,15).
What are the key properties of 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide?
5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide has a molecular weight of 239.23 g/mol, XLogP of -0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-oxomorpholin-4-yl)methyl]furan-2-carbohydrazide is sourced from PubChem (CID 79468557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).