2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide

C10H17N5O3 — CID 63583631

IUPAC2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide
SMILESCC(C)N(CC(N)=O)Cc1cc(C(=O)NN)no1
InChIInChI=1S/C10H17N5O3/c1-6(2)15(5-9(11)16)4-7-3-8(14-18-7)10(17)13-12/h3,6H,4-5,12H2,1-2H3,(H2,11,16)(H,13,17)
InChIKeyDIJAZNCPZKFEIZ-UHFFFAOYSA-N
MW255.28 g/mol
LogP-1.03
Rot. Bonds6

About 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide

2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide (PubChem CID 63583631) has the molecular formula C10H17N5O3 and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide
PubChem CID63583631
Molecular FormulaC10H17N5O3
Molecular Weight255.28 g/mol
Exact Mass255.13
IUPAC Name2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide
SMILESCC(C)N(CC(N)=O)Cc1cc(C(=O)NN)no1
InChIInChI=1S/C10H17N5O3/c1-6(2)15(5-9(11)16)4-7-3-8(14-18-7)10(17)13-12/h3,6H,4-5,12H2,1-2H3,(H2,11,16)(H,13,17)
InChIKeyDIJAZNCPZKFEIZ-UHFFFAOYSA-N
XLogP-1.03
TPSA127.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 5-1.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-methylamino]acetamide
CID 63571778
5-[[3-hydroxypropyl(propan-2-yl)amino]methyl]-1,2-oxazole-3-carbohydrazide
CID 63579150
5-[[methyl(propan-2-yl)amino]methyl]-1,2-oxazole-3-carbohydrazide
CID 63570255
5-[[butan-2-yl(ethyl)amino]methyl]-1,2-oxazole-3-carbohydrazide
CID 63572716
5-[(dibutylamino)methyl]-1,2-oxazole-3-carbohydrazide
CID 63572496
2-[[6-(hydrazinecarbonyl)-2-pyridinyl]methyl-propan-2-ylamino]acetamide
CID 106909180
5-[[methyl(2-methylsulfanylethyl)amino]methyl]-1,2-oxazole-3-carbohydrazide
CID 112666606
5-[(4-hydroxy-N-methylanilino)methyl]-1,2-oxazole-3-carbohydrazide
CID 63569750
5-[[5-hydroxypentyl(methyl)amino]methyl]-1,2-oxazole-3-carbohydrazide
CID 107206508
5-[[methyl(thiophen-2-ylmethyl)amino]methyl]-1,2-oxazole-3-carbohydrazide
CID 63571789
5-[[(2-amino-2-oxoethyl)-methylamino]methyl]-1,2-oxazole-3-carboxylic acid
CID 61397938
5-(3-hydroxybutan-2-ylsulfanylmethyl)-1,2-oxazole-3-carbohydrazide
CID 107772095

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide?
The IUPAC name of 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide (CID 63583631) is 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide is CC(C)N(CC(N)=O)Cc1cc(C(=O)NN)no1.
What is the InChIKey of 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide?
The InChIKey is DIJAZNCPZKFEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O3/c1-6(2)15(5-9(11)16)4-7-3-8(14-18-7)10(17)13-12/h3,6H,4-5,12H2,1-2H3,(H2,11,16)(H,13,17).
What are the key properties of 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide?
2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide has a molecular weight of 255.28 g/mol, XLogP of -1.03, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(hydrazinecarbonyl)-1,2-oxazol-5-yl]methyl-propan-2-ylamino]acetamide is sourced from PubChem (CID 63583631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).