N-(2-phenylethylideneamino)nonanamide

C17H26N2O — CID 3280851

IUPACN-(2-phenylethylideneamino)nonanamide
SMILESCCCCCCCCC(=O)NN=CCc1ccccc1
InChIInChI=1S/C17H26N2O/c1-2-3-4-5-6-10-13-17(20)19-18-15-14-16-11-8-7-9-12-16/h7-9,11-12,15H,2-6,10,13-14H2,1H3,(H,19,20)
InChIKeyDTYMYDXTHHXEKD-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.08
Rot. Bonds10

About N-(2-phenylethylideneamino)nonanamide

N-(2-phenylethylideneamino)nonanamide (PubChem CID 3280851) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(2-phenylethylideneamino)nonanamide.

Molecular Properties

Compound NameN-(2-phenylethylideneamino)nonanamide
PubChem CID3280851
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(2-phenylethylideneamino)nonanamide
SMILESCCCCCCCCC(=O)NN=CCc1ccccc1
InChIInChI=1S/C17H26N2O/c1-2-3-4-5-6-10-13-17(20)19-18-15-14-16-11-8-7-9-12-16/h7-9,11-12,15H,2-6,10,13-14H2,1H3,(H,19,20)
InChIKeyDTYMYDXTHHXEKD-UHFFFAOYSA-N
XLogP4.08
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-2-phenylethylideneamino]butanamide
CID 17340082
N-(3-phenylpropylideneamino)dodecanamide
CID 3728089
N-[(E)-benzylideneamino]heptanamide
CID 6083821
N-(benzylideneamino)decanamide
CID 3430585
N-(2-phenylpropylideneamino)heptanamide
CID 4588696
N-[[(E)-3-phenylprop-2-enylidene]amino]octanamide
CID 129439051
N-(cinnamylideneamino)undecanamide
CID 3458193
N-(nonylideneamino)decanamide
CID 5084396
N-(butylideneamino)heptanamide
CID 4641242
N-(nonylideneamino)octanamide
CID 4295690
N-[(2-hydroxyphenyl)methylideneamino]octanamide
CID 3393777
N-[(2-hydroxyphenyl)methylideneamino]undecanamide
CID 5053269

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethylideneamino)nonanamide?
The IUPAC name of N-(2-phenylethylideneamino)nonanamide (CID 3280851) is N-(2-phenylethylideneamino)nonanamide.
What is the SMILES notation for N-(2-phenylethylideneamino)nonanamide?
The canonical SMILES for N-(2-phenylethylideneamino)nonanamide is CCCCCCCCC(=O)NN=CCc1ccccc1.
What is the InChIKey of N-(2-phenylethylideneamino)nonanamide?
The InChIKey is DTYMYDXTHHXEKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-3-4-5-6-10-13-17(20)19-18-15-14-16-11-8-7-9-12-16/h7-9,11-12,15H,2-6,10,13-14H2,1H3,(H,19,20).
What are the key properties of N-(2-phenylethylideneamino)nonanamide?
N-(2-phenylethylideneamino)nonanamide has a molecular weight of 274.41 g/mol, XLogP of 4.08, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethylideneamino)nonanamide is sourced from PubChem (CID 3280851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).