4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide

C24H32N2O3 — CID 17196211

IUPAC4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(NC(=O)C(C)Oc2ccc(CC)cc2)cc1
InChIInChI=1S/C24H32N2O3/c1-5-16-26(17-6-2)24(28)20-10-12-21(13-11-20)25-23(27)18(4)29-22-14-8-19(7-3)9-15-22/h8-15,18H,5-7,16-17H2,1-4H3,(H,25,27)
InChIKeySXRGBGAODFNNSF-UHFFFAOYSA-N
MW396.53 g/mol
LogP4.92
Rot. Bonds10

About 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide

4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide (PubChem CID 17196211) has the molecular formula C24H32N2O3 and a molecular weight of 396.53 g/mol. Its IUPAC name is 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide.

Molecular Properties

Compound Name4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide
PubChem CID17196211
Molecular FormulaC24H32N2O3
Molecular Weight396.53 g/mol
Exact Mass396.24
IUPAC Name4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(NC(=O)C(C)Oc2ccc(CC)cc2)cc1
InChIInChI=1S/C24H32N2O3/c1-5-16-26(17-6-2)24(28)20-10-12-21(13-11-20)25-23(27)18(4)29-22-14-8-19(7-3)9-15-22/h8-15,18H,5-7,16-17H2,1-4H3,(H,25,27)
InChIKeySXRGBGAODFNNSF-UHFFFAOYSA-N
XLogP4.92
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.53
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(4-chlorophenoxy)propanoylamino]-N,N-dipropylbenzamide
CID 17196176
(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide
CID 8604722
N-(4-acetamidophenyl)-2-(4-ethylphenoxy)propanamide
CID 4953258
N-ethyl-4-[2-(4-ethylphenoxy)propanoylamino]benzamide
CID 17234371
N-[4-(diethylamino)phenyl]-2-(4-ethylphenoxy)propanamide
CID 4953277
2-(4-bromophenoxy)-N-(4-ethylphenyl)propanamide
CID 132791420
N,N-diethyl-4-[[(2S)-2-phenoxypropanoyl]amino]benzamide
CID 8503969
(2S)-2-(4-tert-butylphenoxy)-N-(4-ethylphenyl)propanamide
CID 7703328
4-[1-(4-ethylanilino)-1-oxopropan-2-yl]oxy-N-(4-fluorophenyl)benzamide
CID 3691715
methyl 4-[2-(4-propylphenoxy)propanoylamino]benzoate
CID 53266101
N-(4-ethylphenyl)-2-(4-formylphenoxy)propanamide
CID 23409645
(2S)-2-(4-ethylphenoxy)-N-[4-(2-methylpropoxy)phenyl]propanamide
CID 9237321

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide?
The IUPAC name of 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide (CID 17196211) is 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide.
What is the SMILES notation for 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide?
The canonical SMILES for 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1ccc(NC(=O)C(C)Oc2ccc(CC)cc2)cc1.
What is the InChIKey of 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide?
The InChIKey is SXRGBGAODFNNSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O3/c1-5-16-26(17-6-2)24(28)20-10-12-21(13-11-20)25-23(27)18(4)29-22-14-8-19(7-3)9-15-22/h8-15,18H,5-7,16-17H2,1-4H3,(H,25,27).
What are the key properties of 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide?
4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide has a molecular weight of 396.53 g/mol, XLogP of 4.92, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide is sourced from PubChem (CID 17196211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).