2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine

C17H26N2O2 — CID 135260346

IUPAC2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine
SMILESC=C(C)C(=O)OCCN(CC)CC.C=Cc1ccccn1
InChIInChI=1S/C10H19NO2.C7H7N/c1-5-11(6-2)7-8-13-10(12)9(3)4;1-2-7-5-3-4-6-8-7/h3,5-8H2,1-2,4H3;2-6H,1H2
InChIKeyZODPNYWWSKHYAJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.17
Rot. Bonds7

About 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine

2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine (PubChem CID 135260346) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine.

Molecular Properties

Compound Name2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine
PubChem CID135260346
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine
SMILESC=C(C)C(=O)OCCN(CC)CC.C=Cc1ccccn1
InChIInChI=1S/C10H19NO2.C7H7N/c1-5-11(6-2)7-8-13-10(12)9(3)4;1-2-7-5-3-4-6-8-7/h3,5-8H2,1-2,4H3;2-6H,1H2
InChIKeyZODPNYWWSKHYAJ-UHFFFAOYSA-N
XLogP3.17
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(diethylamino)ethyl 2-methylprop-2-enoate;hydrazine
CID 161237625
ethane-1,2-diol;2-ethenylpyridine;bis(2-methylprop-2-enoic acid)
CID 174381680
2-ethenylpyridine;bis(2-methylbuta-1,3-diene)
CID 19427631
[3-[3-[2-(diethylamino)ethoxy]-3-oxopropoxy]-3-oxopropyl] 2-methylprop-2-enoate
CID 20659271
2-(diethylamino)ethyl 2-methylprop-2-enoate;N-ethylprop-2-enamide;methane
CID 161409865
2-ethenylpyridine;propan-1-amine
CID 174607144
2-[2-ethoxyethyl(ethyl)amino]ethyl 2-methylprop-2-enoate
CID 88906932
2-(diethylamino)ethyl 2-methylprop-2-enoate;diethyl sulfate
CID 162214981
6-[4-[4-[6-[4-[(E)-2-pyridin-2-ylethenyl]phenoxy]hexoxy]phenyl]phenoxy]hexyl 2-methylprop-2-enoate
CID 101112542
2-[bis(prop-2-enyl)amino]ethyl 2-methylprop-2-enoate;prop-2-enyl prop-2-enoate;styrene
CID 69095633
10-(diethylamino)decyl 2-methylprop-2-enoate
CID 88816088
2-ethenylpyridine;hydrate
CID 67843107

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine?
The IUPAC name of 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine (CID 135260346) is 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine.
What is the SMILES notation for 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine?
The canonical SMILES for 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine is C=C(C)C(=O)OCCN(CC)CC.C=Cc1ccccn1.
What is the InChIKey of 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine?
The InChIKey is ZODPNYWWSKHYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2.C7H7N/c1-5-11(6-2)7-8-13-10(12)9(3)4;1-2-7-5-3-4-6-8-7/h3,5-8H2,1-2,4H3;2-6H,1H2.
What are the key properties of 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine?
2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine has a molecular weight of 290.41 g/mol, XLogP of 3.17, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)ethyl 2-methylprop-2-enoate;2-ethenylpyridine is sourced from PubChem (CID 135260346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).