N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide

C20H32N2O — CID 6262832

IUPACN-[(E)-1-(4-methylphenyl)propylideneamino]decanamide
SMILESCCCCCCCCCC(=O)N/N=C(\CC)c1ccc(C)cc1
InChIInChI=1S/C20H32N2O/c1-4-6-7-8-9-10-11-12-20(23)22-21-19(5-2)18-15-13-17(3)14-16-18/h13-16H,4-12H2,1-3H3,(H,22,23)/b21-19+
InChIKeyIGBQNGPDHMSQFD-XUTLUUPISA-N
MW316.49 g/mol
LogP5.37
Rot. Bonds11

About N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide

N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide (PubChem CID 6262832) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide.

Molecular Properties

Compound NameN-[(E)-1-(4-methylphenyl)propylideneamino]decanamide
PubChem CID6262832
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC NameN-[(E)-1-(4-methylphenyl)propylideneamino]decanamide
SMILESCCCCCCCCCC(=O)N/N=C(\CC)c1ccc(C)cc1
InChIInChI=1S/C20H32N2O/c1-4-6-7-8-9-10-11-12-20(23)22-21-19(5-2)18-15-13-17(3)14-16-18/h13-16H,4-12H2,1-3H3,(H,22,23)/b21-19+
InChIKeyIGBQNGPDHMSQFD-XUTLUUPISA-N
XLogP5.37
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.49
LogP ≤ 55.37
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)-1-(4-hydroxyphenyl)propylideneamino]dodecanamide
CID 135704395
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]hexanamide
CID 136716001
N-[(E)-1-(4-chlorophenyl)propylideneamino]hexanamide
CID 6029977
N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide
CID 6004456
N-(1-phenylpropylideneamino)pentanamide
CID 4996868
N,N'-bis[(E)-1-(4-hydroxyphenyl)propylideneamino]hexanediamide
CID 135721513
[(Z)-1-(4-methylphenyl)dodecylideneamino]urea
CID 6056563
N-(1-phenylpentylideneamino)octanamide
CID 4676930
N-[(E)-1-(4-methoxyphenyl)propylideneamino]pentanamide
CID 6379049
N-[(E)-1-(3-chlorophenyl)propylideneamino]nonanamide
CID 6063002
N-[1-(2,4-dimethylphenyl)ethylideneamino]decanamide
CID 3291865
N-[(E)-1-(2-hydroxyphenyl)propylideneamino]dodecanamide
CID 135533779

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide?
The IUPAC name of N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide (CID 6262832) is N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide.
What is the SMILES notation for N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide?
The canonical SMILES for N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide is CCCCCCCCCC(=O)N/N=C(\CC)c1ccc(C)cc1.
What is the InChIKey of N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide?
The InChIKey is IGBQNGPDHMSQFD-XUTLUUPISA-N. The full InChI is InChI=1S/C20H32N2O/c1-4-6-7-8-9-10-11-12-20(23)22-21-19(5-2)18-15-13-17(3)14-16-18/h13-16H,4-12H2,1-3H3,(H,22,23)/b21-19+.
What are the key properties of N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide?
N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide has a molecular weight of 316.49 g/mol, XLogP of 5.37, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide is sourced from PubChem (CID 6262832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).