N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide

C24H25N3O3 — CID 55696777

IUPACN-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide
SMILESCCc1ccccc1NC(=O)CN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C24H25N3O3/c1-3-18-9-7-8-12-22(18)26-23(28)17-27(2)24(29)25-19-13-15-21(16-14-19)30-20-10-5-4-6-11-20/h4-16H,3,17H2,1-2H3,(H,25,29)(H,26,28)
InChIKeyBVPWKMZGFIAHGA-UHFFFAOYSA-N
MW403.48 g/mol
LogP5.14
Rot. Bonds7

About N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide

N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide (PubChem CID 55696777) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide
PubChem CID55696777
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide
SMILESCCc1ccccc1NC(=O)CN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C24H25N3O3/c1-3-18-9-7-8-12-22(18)26-23(28)17-27(2)24(29)25-19-13-15-21(16-14-19)30-20-10-5-4-6-11-20/h4-16H,3,17H2,1-2H3,(H,25,29)(H,26,28)
InChIKeyBVPWKMZGFIAHGA-UHFFFAOYSA-N
XLogP5.14
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.48
LogP ≤ 55.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-2-[methyl-(2-phenoxyacetyl)amino]acetamide
CID 8699505
2-[ethyl-[2-(2-ethylanilino)-2-oxoethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 9027158
N-(2-ethylphenyl)-2-[methyl-[[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]carbamoyl]amino]acetamide
CID 56519450
2-[[4-ethoxy-2-(trifluoromethyl)phenyl]carbamoyl-methylamino]-N-(2-ethylphenyl)acetamide
CID 60589161
N-(4-bromophenyl)-2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]acetamide
CID 46562888
N-[2-(2-ethylanilino)-2-oxoethyl]-3-(2-fluorophenyl)-N-methylpropanamide
CID 51181026
1-(2,2-diethoxyethyl)-1-methyl-3-(4-phenoxyphenyl)urea
CID 23451795
2-[(4-fluorophenyl)carbamoyl-methylamino]-N-phenylacetamide
CID 134121107
3-[4-(difluoromethoxy)phenyl]-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 86922903
N-(2-ethylphenyl)-2-[[2-(4-formylphenoxy)acetyl]-methylamino]acetamide
CID 78761830
2-[[2-(4-ethoxyphenyl)sulfanylacetyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 9428602
N-(2-ethylphenyl)-2-[[2-(3-fluorophenoxy)acetyl]-methylamino]acetamide
CID 8699564

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide (CID 55696777) is N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide is CCc1ccccc1NC(=O)CN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide?
The InChIKey is BVPWKMZGFIAHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-3-18-9-7-8-12-22(18)26-23(28)17-27(2)24(29)25-19-13-15-21(16-14-19)30-20-10-5-4-6-11-20/h4-16H,3,17H2,1-2H3,(H,25,29)(H,26,28).
What are the key properties of N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide?
N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide has a molecular weight of 403.48 g/mol, XLogP of 5.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide is sourced from PubChem (CID 55696777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).