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

C20H32N2O2 — CID 6004456

IUPACN-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide
SMILESCCCCCCCCCC(=O)N/N=C(\CC)c1ccc(OC)cc1
InChIInChI=1S/C20H32N2O2/c1-4-6-7-8-9-10-11-12-20(23)22-21-19(5-2)17-13-15-18(24-3)16-14-17/h13-16H,4-12H2,1-3H3,(H,22,23)/b21-19+
InChIKeyBIGSMOYAVZUYIQ-XUTLUUPISA-N
MW332.49 g/mol
LogP5.07
Rot. Bonds12

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

N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide (PubChem CID 6004456) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide.

Molecular Properties

Compound NameN-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide
PubChem CID6004456
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC NameN-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide
SMILESCCCCCCCCCC(=O)N/N=C(\CC)c1ccc(OC)cc1
InChIInChI=1S/C20H32N2O2/c1-4-6-7-8-9-10-11-12-20(23)22-21-19(5-2)17-13-15-18(24-3)16-14-17/h13-16H,4-12H2,1-3H3,(H,22,23)/b21-19+
InChIKeyBIGSMOYAVZUYIQ-XUTLUUPISA-N
XLogP5.07
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.49
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-methoxyphenyl)propylideneamino]pentanamide
CID 6379049
N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide
CID 6262832
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,N'-bis[1-(4-methoxyphenyl)ethylideneamino]octanediamide
CID 3411990
N-(1-phenylpropylideneamino)pentanamide
CID 4996868
N,N'-bis[(E)-1-(4-hydroxyphenyl)propylideneamino]hexanediamide
CID 135721513
4-methoxy-N-[(E)-1-phenylhexylideneamino]benzamide
CID 6370113
4-(4-chloro-2-methylphenoxy)-N-[1-(4-methoxyphenyl)propylideneamino]butanamide
CID 4648642
N-(1-phenylpentylideneamino)octanamide
CID 4676930
N-[(4-methoxyphenyl)methylideneamino]nonanamide
CID 4175341

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide?
The IUPAC name of N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide (CID 6004456) is N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide.
What is the SMILES notation for N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide?
The canonical SMILES for N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide is CCCCCCCCCC(=O)N/N=C(\CC)c1ccc(OC)cc1.
What is the InChIKey of N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide?
The InChIKey is BIGSMOYAVZUYIQ-XUTLUUPISA-N. The full InChI is InChI=1S/C20H32N2O2/c1-4-6-7-8-9-10-11-12-20(23)22-21-19(5-2)17-13-15-18(24-3)16-14-17/h13-16H,4-12H2,1-3H3,(H,22,23)/b21-19+.
What are the key properties of N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide?
N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide has a molecular weight of 332.49 g/mol, XLogP of 5.07, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(4-methoxyphenyl)propylideneamino]decanamide is sourced from PubChem (CID 6004456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).