N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide

C24H30N2O4 — CID 78902869

IUPACN-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide
SMILESO=C(COc1cccc(NC(=O)c2ccccc2)c1)NCCCOC1CCCCC1
InChIInChI=1S/C24H30N2O4/c27-23(25-15-8-16-29-21-12-5-2-6-13-21)18-30-22-14-7-11-20(17-22)26-24(28)19-9-3-1-4-10-19/h1,3-4,7,9-11,14,17,21H,2,5-6,8,12-13,15-16,18H2,(H,25,27)(H,26,28)
InChIKeyWIYHDUGTHCHTCA-UHFFFAOYSA-N
MW410.51 g/mol
LogP4.17
Rot. Bonds10

About N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide

N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide (PubChem CID 78902869) has the molecular formula C24H30N2O4 and a molecular weight of 410.51 g/mol. Its IUPAC name is N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide
PubChem CID78902869
Molecular FormulaC24H30N2O4
Molecular Weight410.51 g/mol
Exact Mass410.22
IUPAC NameN-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide
SMILESO=C(COc1cccc(NC(=O)c2ccccc2)c1)NCCCOC1CCCCC1
InChIInChI=1S/C24H30N2O4/c27-23(25-15-8-16-29-21-12-5-2-6-13-21)18-30-22-14-7-11-20(17-22)26-24(28)19-9-3-1-4-10-19/h1,3-4,7,9-11,14,17,21H,2,5-6,8,12-13,15-16,18H2,(H,25,27)(H,26,28)
InChIKeyWIYHDUGTHCHTCA-UHFFFAOYSA-N
XLogP4.17
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.51
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-cyclohexyloxypropyl)-2-(3-methylphenoxy)acetamide
CID 134029943
N-(3-cyclohexyloxypropyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 40659124
N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide
CID 134030025
N-(3-cyclohexyloxypropyl)-2-(2-nitrophenoxy)acetamide
CID 51222276
N-[3-[2-[2-(cycloheptylamino)ethylamino]-2-oxoethoxy]phenyl]cyclopropanecarboxamide;hydrochloride
CID 119621061
N-[3-[2-[[N'-(3-cyclohexyloxypropyl)-N-ethylcarbamimidoyl]amino]ethoxy]phenyl]acetamide
CID 111397642
N-[3-[2-[(4-chlorophenyl)methylamino]-2-oxoethoxy]phenyl]benzamide
CID 78883909
1-(3-cyclohexyloxypropyl)-3-(3-methoxyphenyl)thiourea
CID 92541834
N-[3-[2-[(2-methylphenyl)methylamino]-2-oxoethoxy]phenyl]benzamide
CID 78883847
N-[3-[2-oxo-2-(4-phenoxyanilino)ethoxy]phenyl]benzamide
CID 18870214
N-cyclopropyl-3-[2-oxo-2-(2-phenoxyethylamino)ethoxy]benzamide
CID 60522738
N-[3-(3-methoxypropoxy)phenyl]benzamide
CID 86997539

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide?
The IUPAC name of N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide (CID 78902869) is N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide.
What is the SMILES notation for N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide?
The canonical SMILES for N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide is O=C(COc1cccc(NC(=O)c2ccccc2)c1)NCCCOC1CCCCC1.
What is the InChIKey of N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide?
The InChIKey is WIYHDUGTHCHTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O4/c27-23(25-15-8-16-29-21-12-5-2-6-13-21)18-30-22-14-7-11-20(17-22)26-24(28)19-9-3-1-4-10-19/h1,3-4,7,9-11,14,17,21H,2,5-6,8,12-13,15-16,18H2,(H,25,27)(H,26,28).
What are the key properties of N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide?
N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide has a molecular weight of 410.51 g/mol, XLogP of 4.17, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(3-cyclohexyloxypropylamino)-2-oxoethoxy]phenyl]benzamide is sourced from PubChem (CID 78902869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).