N-(3-aminophenyl)-N-ethyldecanamide

C18H30N2O — CID 65448348

IUPACN-(3-aminophenyl)-N-ethyldecanamide
SMILESCCCCCCCCCC(=O)N(CC)c1cccc(N)c1
InChIInChI=1S/C18H30N2O/c1-3-5-6-7-8-9-10-14-18(21)20(4-2)17-13-11-12-16(19)15-17/h11-13,15H,3-10,14,19H2,1-2H3
InChIKeySQWTXLINIKDGFP-UHFFFAOYSA-N
MW290.45 g/mol
LogP4.76
Rot. Bonds10

About N-(3-aminophenyl)-N-ethyldecanamide

N-(3-aminophenyl)-N-ethyldecanamide (PubChem CID 65448348) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-(3-aminophenyl)-N-ethyldecanamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-N-ethyldecanamide
PubChem CID65448348
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-(3-aminophenyl)-N-ethyldecanamide
SMILESCCCCCCCCCC(=O)N(CC)c1cccc(N)c1
InChIInChI=1S/C18H30N2O/c1-3-5-6-7-8-9-10-14-18(21)20(4-2)17-13-11-12-16(19)15-17/h11-13,15H,3-10,14,19H2,1-2H3
InChIKeySQWTXLINIKDGFP-UHFFFAOYSA-N
XLogP4.76
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-N-(3-hydroxyphenyl)heptanamide
CID 107736474
N-ethyl-N-phenyloctadecanamide
CID 151424183
N-(3-aminophenyl)-3-cyclopentyl-N-ethylpropanamide
CID 63229916
N-(3-aminophenyl)-2-cyclopropyl-N-ethylacetamide
CID 63229837
N-[4-(aminomethyl)phenyl]-N-ethylhexanamide
CID 43275627
heptyl 6-(N-ethylanilino)-6-oxohexanoate
CID 91711017
N-[(3-aminophenyl)methyl]-N-ethylhexanamide
CID 43383879
N-(3-aminophenyl)-N-ethylbenzamide
CID 63229786
N-(3-aminophenyl)-2-(2,5-dimethylphenyl)-N-ethylacetamide
CID 63230005
1-(3-aminophenyl)decan-1-one
CID 116548502
N-ethyl-N-(4-fluorophenyl)hexanamide
CID 78806862
1-(3-aminophenyl)undecan-1-one
CID 116548557

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-N-ethyldecanamide?
The IUPAC name of N-(3-aminophenyl)-N-ethyldecanamide (CID 65448348) is N-(3-aminophenyl)-N-ethyldecanamide.
What is the SMILES notation for N-(3-aminophenyl)-N-ethyldecanamide?
The canonical SMILES for N-(3-aminophenyl)-N-ethyldecanamide is CCCCCCCCCC(=O)N(CC)c1cccc(N)c1.
What is the InChIKey of N-(3-aminophenyl)-N-ethyldecanamide?
The InChIKey is SQWTXLINIKDGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-3-5-6-7-8-9-10-14-18(21)20(4-2)17-13-11-12-16(19)15-17/h11-13,15H,3-10,14,19H2,1-2H3.
What are the key properties of N-(3-aminophenyl)-N-ethyldecanamide?
N-(3-aminophenyl)-N-ethyldecanamide has a molecular weight of 290.45 g/mol, XLogP of 4.76, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-N-ethyldecanamide is sourced from PubChem (CID 65448348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).