10-(diethylamino)decyl 2-methylprop-2-enoate

C18H35NO2 — CID 88816088

IUPAC10-(diethylamino)decyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCCCCCCCCN(CC)CC
InChIInChI=1S/C18H35NO2/c1-5-19(6-2)15-13-11-9-7-8-10-12-14-16-21-18(20)17(3)4/h3,5-16H2,1-2,4H3
InChIKeyVAMTYZWLZHRBGJ-UHFFFAOYSA-N
MW297.48 g/mol
LogP4.57
Rot. Bonds14

About 10-(diethylamino)decyl 2-methylprop-2-enoate

10-(diethylamino)decyl 2-methylprop-2-enoate (PubChem CID 88816088) has the molecular formula C18H35NO2 and a molecular weight of 297.48 g/mol. Its IUPAC name is 10-(diethylamino)decyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name10-(diethylamino)decyl 2-methylprop-2-enoate
PubChem CID88816088
Molecular FormulaC18H35NO2
Molecular Weight297.48 g/mol
Exact Mass297.27
IUPAC Name10-(diethylamino)decyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCCCCCCCCN(CC)CC
InChIInChI=1S/C18H35NO2/c1-5-19(6-2)15-13-11-9-7-8-10-12-14-16-21-18(20)17(3)4/h3,5-16H2,1-2,4H3
InChIKeyVAMTYZWLZHRBGJ-UHFFFAOYSA-N
XLogP4.57
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.48
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-(diethylamino)ethyl 2-methylprop-2-enoate;hydrazine
CID 161237625
3-[ethyl(2-hydroxyethyl)amino]propyl 2-methylprop-2-enoate
CID 87217880
butyl 2-methylprop-2-enoate;2-(diethylamino)ethyl 2-methylprop-2-enoate;methyl 2-methylprop-2-enoate;octadecyl 2-methylprop-2-enoate
CID 173140815
ethene;4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate;6-(2-methylprop-2-enoyloxy)hexyl 2-methylprop-2-enoate
CID 88685309
8-(dimethylamino)octyl 2-methylprop-2-enoate;hydrobromide
CID 141499392
octatetracontyl 2-methylprop-2-enoate
CID 141233444
bis[6-(diethylamino)hexyl] carbonate
CID 54452513
decyl 2-methylprop-2-enoate;dodecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;pentadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate;tridecyl 2-methylprop-2-enoate;undecyl 2-methylprop-2-enoate
CID 164995054
decyl 2-methylprop-2-enoate;dodecyl 2-methylprop-2-enoate;heptadecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;nonadecyl 2-methylprop-2-enoate;nonyl 2-methylprop-2-enoate;octadecyl 2-methylprop-2-enoate;pentadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate;tridecyl 2-methylprop-2-enoate;undecyl 2-methylprop-2-enoate
CID 161498189
dodecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;icosyl 2-methylprop-2-enoate;octadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate
CID 170851547
2-(dipentylamino)ethyl 2-methylprop-2-enoate
CID 54255314
bis[4-(2-methylprop-2-enoyloxy)butyl] oxalate
CID 118147382

Frequently Asked Questions

What is the IUPAC name of 10-(diethylamino)decyl 2-methylprop-2-enoate?
The IUPAC name of 10-(diethylamino)decyl 2-methylprop-2-enoate (CID 88816088) is 10-(diethylamino)decyl 2-methylprop-2-enoate.
What is the SMILES notation for 10-(diethylamino)decyl 2-methylprop-2-enoate?
The canonical SMILES for 10-(diethylamino)decyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCCCCCCCCCN(CC)CC.
What is the InChIKey of 10-(diethylamino)decyl 2-methylprop-2-enoate?
The InChIKey is VAMTYZWLZHRBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO2/c1-5-19(6-2)15-13-11-9-7-8-10-12-14-16-21-18(20)17(3)4/h3,5-16H2,1-2,4H3.
What are the key properties of 10-(diethylamino)decyl 2-methylprop-2-enoate?
10-(diethylamino)decyl 2-methylprop-2-enoate has a molecular weight of 297.48 g/mol, XLogP of 4.57, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(diethylamino)decyl 2-methylprop-2-enoate is sourced from PubChem (CID 88816088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).