(2E,4E)-N,N-dimethyldodeca-2,4-dienamide

C14H25NO — CID 118028564

IUPAC(2E,4E)-N,N-dimethyldodeca-2,4-dienamide
SMILESCCCCCCC/C=C/C=C/C(=O)N(C)C
InChIInChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-12-13-14(16)15(2)3/h10-13H,4-9H2,1-3H3/b11-10+,13-12+
InChIKeyHEKSMTMYGRPVBC-AQASXUMVSA-N
MW223.36 g/mol
LogP3.55
Rot. Bonds8

About (2E,4E)-N,N-dimethyldodeca-2,4-dienamide

(2E,4E)-N,N-dimethyldodeca-2,4-dienamide (PubChem CID 118028564) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (2E,4E)-N,N-dimethyldodeca-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-N,N-dimethyldodeca-2,4-dienamide
PubChem CID118028564
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(2E,4E)-N,N-dimethyldodeca-2,4-dienamide
SMILESCCCCCCC/C=C/C=C/C(=O)N(C)C
InChIInChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-12-13-14(16)15(2)3/h10-13H,4-9H2,1-3H3/b11-10+,13-12+
InChIKeyHEKSMTMYGRPVBC-AQASXUMVSA-N
XLogP3.55
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.55
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(E)-N,N-diethyl dec-2-enamide
CID 72548612
(E)-N,N-dimethylnon-2-enamide
CID 11458077
(E)-N,N-dimethylhex-2-enamide
CID 13508348
(2e,4e)-N,N-dimethyldeca-2,4-dienamide
CID 118028568
(2Z,4E)-N,N,2-trimethylnona-2,4-dienamide
CID 121013749
(Z)-N,N-dimethyloct-2-enamide
CID 134940860
(2E)-N,N-dimethyldeca-2,4-dienamide
CID 134948560
(3E)-1-methyl-1-azacyclotridec-3-en-2-one
CID 166438543
(2E,6E)-N,N-dimethylnona-2,6-dienamide
CID 17973407
(E)-3-ethyl-N,N-dimethylhept-2-enamide
CID 92033356
(2E,4E)-N-methoxy-N-methylundeca-2,4-dienamide
CID 102151791
(2E,4E,8Z)-N,N-dimethylundeca-2,4,8-trienamide
CID 11298718

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-N,N-dimethyldodeca-2,4-dienamide?
The IUPAC name of (2E,4E)-N,N-dimethyldodeca-2,4-dienamide (CID 118028564) is (2E,4E)-N,N-dimethyldodeca-2,4-dienamide.
What is the SMILES notation for (2E,4E)-N,N-dimethyldodeca-2,4-dienamide?
The canonical SMILES for (2E,4E)-N,N-dimethyldodeca-2,4-dienamide is CCCCCCC/C=C/C=C/C(=O)N(C)C.
What is the InChIKey of (2E,4E)-N,N-dimethyldodeca-2,4-dienamide?
The InChIKey is HEKSMTMYGRPVBC-AQASXUMVSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-12-13-14(16)15(2)3/h10-13H,4-9H2,1-3H3/b11-10+,13-12+.
What are the key properties of (2E,4E)-N,N-dimethyldodeca-2,4-dienamide?
(2E,4E)-N,N-dimethyldodeca-2,4-dienamide has a molecular weight of 223.36 g/mol, XLogP of 3.55, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-N,N-dimethyldodeca-2,4-dienamide is sourced from PubChem (CID 118028564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).