(E)-N,N-diethyldec-2-enamide

C14H27NO — CID 72548612

IUPAC(E)-N,N-diethyldec-2-enamide
SMILESCCCCCCC/C=C/C(=O)N(CC)CC
InChIInChI=1S/C14H27NO/c1-4-7-8-9-10-11-12-13-14(16)15(5-2)6-3/h12-13H,4-11H2,1-3H3/b13-12+
InChIKeyKGASFIOKWFYBAO-OUKQBFOZSA-N
MW225.38 g/mol
LogP3.77
Rot. Bonds9

About (E)-N,N-diethyldec-2-enamide

(E)-N,N-diethyldec-2-enamide (PubChem CID 72548612) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is (E)-N,N-diethyldec-2-enamide.

Molecular Properties

Compound Name(E)-N,N-diethyldec-2-enamide
PubChem CID72548612
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name(E)-N,N-diethyldec-2-enamide
SMILESCCCCCCC/C=C/C(=O)N(CC)CC
InChIInChI=1S/C14H27NO/c1-4-7-8-9-10-11-12-13-14(16)15(5-2)6-3/h12-13H,4-11H2,1-3H3/b13-12+
InChIKeyKGASFIOKWFYBAO-OUKQBFOZSA-N
XLogP3.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

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N-Oleylmaleimide
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1-[(E)-2-Hexadecenoyl]piperidine
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(2E,4E)-1-(Pyrrolidin-1-yl)tetradeca-2,4-dien-1-one
CID 10923868
1-[(E)-2-Tetradecenoyl]piperidine
CID 91715829
1-[(E)-2-Eicosenoyl]piperidine
CID 91715953
(E)-1-(azepan-1-yl)hexadec-2-en-1-one
CID 145964780
(E)-1-(azocan-1-yl)tetradec-2-en-1-one
CID 145966227
(E)-1-(azocan-1-yl)octadec-2-en-1-one
CID 145966375
(E)-1-(azepan-1-yl)octadec-2-en-1-one
CID 145974848

Frequently Asked Questions

What is the IUPAC name of (E)-N,N-diethyldec-2-enamide?
The IUPAC name of (E)-N,N-diethyldec-2-enamide (CID 72548612) is (E)-N,N-diethyldec-2-enamide.
What is the SMILES notation for (E)-N,N-diethyldec-2-enamide?
The canonical SMILES for (E)-N,N-diethyldec-2-enamide is CCCCCCC/C=C/C(=O)N(CC)CC.
What is the InChIKey of (E)-N,N-diethyldec-2-enamide?
The InChIKey is KGASFIOKWFYBAO-OUKQBFOZSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-7-8-9-10-11-12-13-14(16)15(5-2)6-3/h12-13H,4-11H2,1-3H3/b13-12+.
What are the key properties of (E)-N,N-diethyldec-2-enamide?
(E)-N,N-diethyldec-2-enamide has a molecular weight of 225.38 g/mol, XLogP of 3.77, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-diethyldec-2-enamide is sourced from PubChem (CID 72548612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).