2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate

C10H17NO4 — CID 89184726

IUPAC2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCNC(=O)C(C)OC
InChIInChI=1S/C10H17NO4/c1-7(2)10(13)15-6-5-11-9(12)8(3)14-4/h8H,1,5-6H2,2-4H3,(H,11,12)
InChIKeyGFLHXNVLRLWFQW-UHFFFAOYSA-N
MW215.25 g/mol
LogP0.26
Rot. Bonds6

About 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate

2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate (PubChem CID 89184726) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate
PubChem CID89184726
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCNC(=O)C(C)OC
InChIInChI=1S/C10H17NO4/c1-7(2)10(13)15-6-5-11-9(12)8(3)14-4/h8H,1,5-6H2,2-4H3,(H,11,12)
InChIKeyGFLHXNVLRLWFQW-UHFFFAOYSA-N
XLogP0.26
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxybutanoylamino)ethyl 2-methylprop-2-enoate
CID 166937691
2-(methoxycarbonylamino)ethyl 2-methylprop-2-enoate;methyl 2-methylprop-2-enoate
CID 158290359
2-(carbonochloridoylamino)ethyl 2-methylprop-2-enoate
CID 18000331
2-[2-[6-[2-[6-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]hexoxy]propanoyloxy]hexoxy]propanoylamino]ethyl 2-methylprop-2-enoate
CID 170087554
2-(2,2-dimethylpropanoylamino)ethyl 2-methylprop-2-enoate
CID 90228448
2-[(methoxycarbonylamino)carbamoylamino]ethyl 2-methylprop-2-enoate
CID 166799947
2-[2-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propoxycarbonylamino]ethyl 2-methylprop-2-enoate
CID 58975887
methyl 2-methylprop-2-enoate;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 3080735
3-acetamidopropyl 2-methylprop-2-enoate
CID 15055173
2-(2,2,4-trimethylpentan-3-yloxycarbonylamino)ethyl 2-methylprop-2-enoate
CID 166881112
2-(iodoamino)ethyl 2-methylprop-2-enoate
CID 144974054
2-[2-[2-methyl-3-[2-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]ethylsulfanyl]propyl]sulfanylethoxycarbonylamino]ethyl 2-methylprop-2-enoate
CID 89211760

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate?
The IUPAC name of 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate (CID 89184726) is 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCNC(=O)C(C)OC.
What is the InChIKey of 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate?
The InChIKey is GFLHXNVLRLWFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-7(2)10(13)15-6-5-11-9(12)8(3)14-4/h8H,1,5-6H2,2-4H3,(H,11,12).
What are the key properties of 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate?
2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate has a molecular weight of 215.25 g/mol, XLogP of 0.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropanoylamino)ethyl 2-methylprop-2-enoate is sourced from PubChem (CID 89184726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).