(dipropylamino) 2-methylprop-2-enoate

C10H19NO2 — CID 54482611

IUPAC(dipropylamino) 2-methylprop-2-enoate
SMILESC=C(C)C(=O)ON(CCC)CCC
InChIInChI=1S/C10H19NO2/c1-5-7-11(8-6-2)13-10(12)9(3)4/h3,5-8H2,1-2,4H3
InChIKeyXQBXGCKZZNVZEC-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.14
Rot. Bonds6

About (dipropylamino) 2-methylprop-2-enoate

(dipropylamino) 2-methylprop-2-enoate (PubChem CID 54482611) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (dipropylamino) 2-methylprop-2-enoate.

Molecular Properties

Compound Name(dipropylamino) 2-methylprop-2-enoate
PubChem CID54482611
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(dipropylamino) 2-methylprop-2-enoate
SMILESC=C(C)C(=O)ON(CCC)CCC
InChIInChI=1S/C10H19NO2/c1-5-7-11(8-6-2)13-10(12)9(3)4/h3,5-8H2,1-2,4H3
InChIKeyXQBXGCKZZNVZEC-UHFFFAOYSA-N
XLogP2.14
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-methylbutan-2-yl(propyl)amino] 2-methylprop-2-enoate;hydrobromide
CID 173426333
3-[ethyl(2-methylprop-2-enoyloxy)amino]propane-1-sulfonic acid
CID 87146950
(dipropylamino) 5-(dimethylamino)-2-methylpent-2-enoate
CID 174759101
N-ethyl-N-methylethanamine;propyl 2-methylprop-2-enoate
CID 172705109
chloromethane;dimethylamino 2-methylprop-2-enoate
CID 172778476
3-(dipropylamino)oxy-3-oxopropanoic acid
CID 19919367
2-[2-[2-(dipropylamino)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 139824188
[2-hydroxy-3-[[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl]-propylamino]propyl] 2-methylprop-2-enoate
CID 87760965
ethyl 2-methylprop-2-enoate
CID 130475774
azane;propyl 2-methylprop-2-enoate
CID 172812841
1-(dihexylamino)propyl 2-methylprop-2-enoate
CID 140511687
2-(didecylamino)oxy-2-oxoacetic acid
CID 175454958

Frequently Asked Questions

What is the IUPAC name of (dipropylamino) 2-methylprop-2-enoate?
The IUPAC name of (dipropylamino) 2-methylprop-2-enoate (CID 54482611) is (dipropylamino) 2-methylprop-2-enoate.
What is the SMILES notation for (dipropylamino) 2-methylprop-2-enoate?
The canonical SMILES for (dipropylamino) 2-methylprop-2-enoate is C=C(C)C(=O)ON(CCC)CCC.
What is the InChIKey of (dipropylamino) 2-methylprop-2-enoate?
The InChIKey is XQBXGCKZZNVZEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-5-7-11(8-6-2)13-10(12)9(3)4/h3,5-8H2,1-2,4H3.
What are the key properties of (dipropylamino) 2-methylprop-2-enoate?
(dipropylamino) 2-methylprop-2-enoate has a molecular weight of 185.27 g/mol, XLogP of 2.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (dipropylamino) 2-methylprop-2-enoate is sourced from PubChem (CID 54482611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).