N,2-dimethyl-N-phenylprop-2-enamide;tridecane

C24H41NO — CID 91328548

IUPACN,2-dimethyl-N-phenylprop-2-enamide;tridecane
SMILESC=C(C)C(=O)N(C)c1ccccc1.CCCCCCCCCCCCC
InChIInChI=1S/C13H28.C11H13NO/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-9(2)11(13)12(3)10-7-5-4-6-8-10/h3-13H2,1-2H3;4-8H,1H2,2-3H3
InChIKeyAIZCYEWLRBOOSP-UHFFFAOYSA-N
MW359.60 g/mol
LogP7.54
Rot. Bonds12

About N,2-dimethyl-N-phenylprop-2-enamide;tridecane

N,2-dimethyl-N-phenylprop-2-enamide;tridecane (PubChem CID 91328548) has the molecular formula C24H41NO and a molecular weight of 359.60 g/mol. Its IUPAC name is N,2-dimethyl-N-phenylprop-2-enamide;tridecane.

Molecular Properties

Compound NameN,2-dimethyl-N-phenylprop-2-enamide;tridecane
PubChem CID91328548
Molecular FormulaC24H41NO
Molecular Weight359.60 g/mol
Exact Mass359.32
IUPAC NameN,2-dimethyl-N-phenylprop-2-enamide;tridecane
SMILESC=C(C)C(=O)N(C)c1ccccc1.CCCCCCCCCCCCC
InChIInChI=1S/C13H28.C11H13NO/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-9(2)11(13)12(3)10-7-5-4-6-8-10/h3-13H2,1-2H3;4-8H,1H2,2-3H3
InChIKeyAIZCYEWLRBOOSP-UHFFFAOYSA-N
XLogP7.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.60
LogP ≤ 57.54
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

N,3-dimethyl-2-methylidene-N-phenylbut-3-enamide
CID 89087492
N-methyl-N-phenylnonanamide
CID 54136731
N-benzyl-N-dodecyl-2-methylprop-2-enamide
CID 141486609
4-amino-N-methyl-N-phenyltetradecanamide
CID 154348615
N-hexyl-N-phenylacetamide
CID 13217997
2-methyl-N-phenyl-N-propylsulfanylprop-2-enamide
CID 20554137
2-methylidene-N-octyl-N-phenylundecanamide
CID 54081211
(E)-N,2-dimethyl-N-phenylbut-2-enamide
CID 10867125
N,2-dimethyl-N-tetracosylprop-2-enamide
CID 87262023
tetradecyl 4-(N-methylanilino)-4-oxobutanoate
CID 91704094
2-methyl-N-naphthalen-1-yl-N-tetradecylprop-2-enamide
CID 175049026
octyl(phenyl)carbamic acid
CID 54301990

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-phenylprop-2-enamide;tridecane?
The IUPAC name of N,2-dimethyl-N-phenylprop-2-enamide;tridecane (CID 91328548) is N,2-dimethyl-N-phenylprop-2-enamide;tridecane.
What is the SMILES notation for N,2-dimethyl-N-phenylprop-2-enamide;tridecane?
The canonical SMILES for N,2-dimethyl-N-phenylprop-2-enamide;tridecane is C=C(C)C(=O)N(C)c1ccccc1.CCCCCCCCCCCCC.
What is the InChIKey of N,2-dimethyl-N-phenylprop-2-enamide;tridecane?
The InChIKey is AIZCYEWLRBOOSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28.C11H13NO/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-9(2)11(13)12(3)10-7-5-4-6-8-10/h3-13H2,1-2H3;4-8H,1H2,2-3H3.
What are the key properties of N,2-dimethyl-N-phenylprop-2-enamide;tridecane?
N,2-dimethyl-N-phenylprop-2-enamide;tridecane has a molecular weight of 359.60 g/mol, XLogP of 7.54, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-phenylprop-2-enamide;tridecane is sourced from PubChem (CID 91328548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).