N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide

C18H28N2O3 — CID 5172800

IUPACN-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide
SMILESCCCCCCCCC(=O)NCC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C18H28N2O3/c1-3-4-5-6-7-8-9-17(21)19-14-18(22)20-15-10-12-16(23-2)13-11-15/h10-13H,3-9,14H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyGXTLWUBNFKHDON-UHFFFAOYSA-N
MW320.43 g/mol
LogP3.50
Rot. Bonds11

About N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide

N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide (PubChem CID 5172800) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide.

Molecular Properties

Compound NameN-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide
PubChem CID5172800
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC NameN-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide
SMILESCCCCCCCCC(=O)NCC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C18H28N2O3/c1-3-4-5-6-7-8-9-17(21)19-14-18(22)20-15-10-12-16(23-2)13-11-15/h10-13H,3-9,14H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyGXTLWUBNFKHDON-UHFFFAOYSA-N
XLogP3.50
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-hydroxyanilino)-2-oxoethyl]heptanamide
CID 22082464
N-butyl-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]octanamide
CID 4167862
N,N'-bis(4-methoxyphenyl)dodecanediamide
CID 5187461
2-(heptylamino)-N-(4-methoxyphenyl)acetamide
CID 54814691
N-[4-[4-(heptanoylamino)phenoxy]phenyl]heptanamide
CID 3351099
[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid
CID 67025275
N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 112998618
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
N-[2-(4-methoxyanilino)-2-oxoethyl]-4-pentylbenzamide
CID 4016608
N-(4-methoxyphenyl)-6-oxooctanamide
CID 15388979
11-bromo-N-(4-methoxyphenyl)undecanamide
CID 51058288

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide?
The IUPAC name of N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide (CID 5172800) is N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide.
What is the SMILES notation for N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide?
The canonical SMILES for N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide is CCCCCCCCC(=O)NCC(=O)Nc1ccc(OC)cc1.
What is the InChIKey of N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide?
The InChIKey is GXTLWUBNFKHDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-3-4-5-6-7-8-9-17(21)19-14-18(22)20-15-10-12-16(23-2)13-11-15/h10-13H,3-9,14H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide?
N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide has a molecular weight of 320.43 g/mol, XLogP of 3.50, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide is sourced from PubChem (CID 5172800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).