4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide

C24H23N3O4 — CID 56549078

IUPAC4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cc1
InChIInChI=1S/C24H23N3O4/c1-2-15-26-23(29)17-3-9-19(10-4-17)27-24(30)18-7-13-21(14-8-18)31-20-11-5-16(6-12-20)22(25)28/h3-14H,2,15H2,1H3,(H2,25,28)(H,26,29)(H,27,30)
InChIKeyOAPGWDKUXFRRHD-UHFFFAOYSA-N
MW417.47 g/mol
LogP3.97
Rot. Bonds8

About 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide

4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide (PubChem CID 56549078) has the molecular formula C24H23N3O4 and a molecular weight of 417.47 g/mol. Its IUPAC name is 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide.

Molecular Properties

Compound Name4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide
PubChem CID56549078
Molecular FormulaC24H23N3O4
Molecular Weight417.47 g/mol
Exact Mass417.17
IUPAC Name4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cc1
InChIInChI=1S/C24H23N3O4/c1-2-15-26-23(29)17-3-9-19(10-4-17)27-24(30)18-7-13-21(14-8-18)31-20-11-5-16(6-12-20)22(25)28/h3-14H,2,15H2,1H3,(H2,25,28)(H,26,29)(H,27,30)
InChIKeyOAPGWDKUXFRRHD-UHFFFAOYSA-N
XLogP3.97
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 53.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-N,4-N-bis[4-(propylcarbamoyl)phenyl]benzene-1,4-dicarboxamide
CID 17219360
4-[4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]phenoxy]benzamide
CID 56545946
4-[(4-heptoxybenzoyl)amino]-N-propylbenzamide
CID 17218814
1-N,4-N-bis(4-carbamoylphenyl)benzene-1,4-dicarboxamide
CID 1272826
methyl N-[4-[[[4-(4-carbamoylphenoxy)benzoyl]amino]methyl]phenyl]carbamate
CID 56548905
4-[4-[(3-propoxyphenyl)carbamoyl]phenoxy]benzamide
CID 56545720
4-[4-[(4-pyrimidin-2-yloxyphenyl)carbamoyl]phenoxy]benzamide
CID 56548979
4-[4-[(6-ethylsulfanyl-3-pyridinyl)carbamoyl]phenoxy]benzamide
CID 56548251
4-[4-[3-[ethylsulfonyl(methyl)amino]propylcarbamoyl]phenoxy]benzamide
CID 56545981
N-(2-methoxyethyl)-4-[(4-propoxybenzoyl)amino]benzamide
CID 17218276
4-[[4-[(2-methylpropan-2-yl)oxy]benzoyl]amino]benzamide
CID 110761803
4-[4-(hydrazinecarbonyl)phenoxy]benzamide
CID 145084998

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide?
The IUPAC name of 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide (CID 56549078) is 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide.
What is the SMILES notation for 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide?
The canonical SMILES for 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide is CCCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cc1.
What is the InChIKey of 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide?
The InChIKey is OAPGWDKUXFRRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O4/c1-2-15-26-23(29)17-3-9-19(10-4-17)27-24(30)18-7-13-21(14-8-18)31-20-11-5-16(6-12-20)22(25)28/h3-14H,2,15H2,1H3,(H2,25,28)(H,26,29)(H,27,30).
What are the key properties of 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide?
4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide has a molecular weight of 417.47 g/mol, XLogP of 3.97, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(4-carbamoylphenoxy)benzoyl]amino]-N-propylbenzamide is sourced from PubChem (CID 56549078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).