2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide

C8H18N4O3 — CID 103229508

IUPAC2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide
SMILESCNC(=O)CN(C)C(COC)C(=O)NN
InChIInChI=1S/C8H18N4O3/c1-10-7(13)4-12(2)6(5-15-3)8(14)11-9/h6H,4-5,9H2,1-3H3,(H,10,13)(H,11,14)
InChIKeyCJHGCIPHQLLZLJ-UHFFFAOYSA-N
MW218.26 g/mol
LogP-2.33
Rot. Bonds6

About 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide

2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide (PubChem CID 103229508) has the molecular formula C8H18N4O3 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide
PubChem CID103229508
Molecular FormulaC8H18N4O3
Molecular Weight218.26 g/mol
Exact Mass218.14
IUPAC Name2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide
SMILESCNC(=O)CN(C)C(COC)C(=O)NN
InChIInChI=1S/C8H18N4O3/c1-10-7(13)4-12(2)6(5-15-3)8(14)11-9/h6H,4-5,9H2,1-3H3,(H,10,13)(H,11,14)
InChIKeyCJHGCIPHQLLZLJ-UHFFFAOYSA-N
XLogP-2.33
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 5-2.33
H-Bond Donors ≤ 53
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-hydroxyethyl(methyl)amino]-3-methoxypropanehydrazide
CID 103229552
3-methoxy-2-[methyl(2-methylpropyl)amino]propanehydrazide
CID 103229498
2-[(2-hydroxy-3-methoxypropyl)-methylamino]-3-methoxypropanehydrazide
CID 103229676
3-methoxy-2-[methyl(2,2,2-trifluoroethyl)amino]propanehydrazide
CID 103229534
3-methoxy-2-[methyl(3-methylbutyl)amino]propanehydrazide
CID 103229666
2-[1-methoxypropan-2-yl(methyl)amino]acetohydrazide
CID 63585055
methyl 2-[methyl-[2-(methylamino)-2-oxoethyl]amino]hexanoate
CID 115868845
ethyl 2-[methyl-[2-(methylamino)-2-oxoethyl]amino]pentanoate
CID 82836304
2-[ethyl(2-methoxyethyl)amino]-3-methoxypropanehydrazide
CID 103229639
2-[(2-amino-3-methoxypropyl)-methylamino]-N-methylacetamide
CID 63760118
2-amino-3-methoxy-N-methyl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 81081950
3-methoxy-2-[methyl-(4-methylcyclohexyl)amino]propanehydrazide
CID 103229662

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide?
The IUPAC name of 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide (CID 103229508) is 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide?
The canonical SMILES for 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide is CNC(=O)CN(C)C(COC)C(=O)NN.
What is the InChIKey of 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide?
The InChIKey is CJHGCIPHQLLZLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O3/c1-10-7(13)4-12(2)6(5-15-3)8(14)11-9/h6H,4-5,9H2,1-3H3,(H,10,13)(H,11,14).
What are the key properties of 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide?
2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide has a molecular weight of 218.26 g/mol, XLogP of -2.33, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydrazinyl-3-methoxy-1-oxopropan-2-yl)-methylamino]-N-methylacetamide is sourced from PubChem (CID 103229508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).