hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate

C9H21N3O3 — CID 81068250

IUPAChydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate
SMILESCC(C)OCCN(C)CCC(=O)ONN
InChIInChI=1S/C9H21N3O3/c1-8(2)14-7-6-12(3)5-4-9(13)15-11-10/h8,11H,4-7,10H2,1-3H3
InChIKeyCFYMUIYXZCDNOE-UHFFFAOYSA-N
MW219.28 g/mol
LogP-0.35
Rot. Bonds8

About hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate

hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate (PubChem CID 81068250) has the molecular formula C9H21N3O3 and a molecular weight of 219.28 g/mol. Its IUPAC name is hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate.

Molecular Properties

Compound Namehydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate
PubChem CID81068250
Molecular FormulaC9H21N3O3
Molecular Weight219.28 g/mol
Exact Mass219.16
IUPAC Namehydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate
SMILESCC(C)OCCN(C)CCC(=O)ONN
InChIInChI=1S/C9H21N3O3/c1-8(2)14-7-6-12(3)5-4-9(13)15-11-10/h8,11H,4-7,10H2,1-3H3
InChIKeyCFYMUIYXZCDNOE-UHFFFAOYSA-N
XLogP-0.35
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

hydrazinyl 3-(2-propan-2-yloxyethoxy)propanoate
CID 66339470
methyl 2-amino-2-methyl-4-[methyl(2-propan-2-yloxyethyl)amino]butanoate
CID 81074648
[2-(hydroxymethyl)-3-[3-[methyl(3-propan-2-yloxypropyl)amino]propanoyloxy]-2-[3-[methyl(3-propan-2-yloxypropyl)amino]propanoyloxymethyl]propyl] 3-[methyl(3-propan-2-yloxypropyl)amino]propanoate
CID 160947398
3-amino-1-methyl-1-(2-propan-2-yloxyethyl)urea
CID 81062243
hydrazinyl 3-[cyclopropylmethyl(methyl)amino]propanoate
CID 66337671
methyl 2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanoate
CID 81062130
hydrazinyl 3-(4-methylpentan-2-yloxy)propanoate
CID 66339650
ethane;2-[methyl(2-propan-2-yloxyethyl)amino]acetic acid
CID 156795596
2-amino-2-methyl-6-[methyl(2-propan-2-yloxyethyl)amino]hexanamide
CID 81061565
2-amino-3-[methyl(2-propan-2-yloxyethyl)amino]propanamide
CID 81062306
5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]thiophene-2-carbohydrazide
CID 81067684
1-[methyl(2-propan-2-yloxyethyl)amino]butan-2-one
CID 81057198

Frequently Asked Questions

What is the IUPAC name of hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate?
The IUPAC name of hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate (CID 81068250) is hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate.
What is the SMILES notation for hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate?
The canonical SMILES for hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate is CC(C)OCCN(C)CCC(=O)ONN.
What is the InChIKey of hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate?
The InChIKey is CFYMUIYXZCDNOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O3/c1-8(2)14-7-6-12(3)5-4-9(13)15-11-10/h8,11H,4-7,10H2,1-3H3.
What are the key properties of hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate?
hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate has a molecular weight of 219.28 g/mol, XLogP of -0.35, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinyl 3-[methyl(2-propan-2-yloxyethyl)amino]propanoate is sourced from PubChem (CID 81068250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).