2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide

C14H20N4O3 — CID 43083279

IUPAC2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C14H20N4O3/c1-4-15-14(21)18-13(20)9(2)16-11-5-7-12(8-6-11)17-10(3)19/h5-9,16H,4H2,1-3H3,(H,17,19)(H2,15,18,20,21)
InChIKeyVWVWURAIWPTKKJ-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.29
Rot. Bonds5

About 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide

2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide (PubChem CID 43083279) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide
PubChem CID43083279
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C14H20N4O3/c1-4-15-14(21)18-13(20)9(2)16-11-5-7-12(8-6-11)17-10(3)19/h5-9,16H,4H2,1-3H3,(H,17,19)(H2,15,18,20,21)
InChIKeyVWVWURAIWPTKKJ-UHFFFAOYSA-N
XLogP1.29
TPSA99.33 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-(ethylcarbamoyl)-2-[4-(propanoylamino)anilino]propanamide
CID 47065348
N-(ethylcarbamoyl)-2-(4-propan-2-yloxyanilino)propanamide
CID 43123150
N-(ethylcarbamoyl)-2-[4-[2-(methylamino)-2-oxoethyl]anilino]propanamide
CID 86924151
(2S)-2-[4-(4-ethoxyphenoxy)anilino]-N-(ethylcarbamoyl)propanamide
CID 32737082
2-(3,4-dicyanoanilino)-N-(ethylcarbamoyl)propanamide
CID 107789245
(2S)-2-(2,3-dihydro-1H-inden-5-ylamino)-N-(ethylcarbamoyl)propanamide
CID 25408683
(2R)-N-(ethylcarbamoyl)-2-[(6-methoxy-3-pyridinyl)amino]propanamide
CID 28888999
N-(ethylcarbamoyl)-2-[4-methyl-3-(trifluoromethyl)anilino]propanamide
CID 17443888
N-(ethylcarbamoyl)-2-(3-fluoro-4-methoxyanilino)propanamide
CID 43380765
N-(ethylcarbamoyl)-2-[3-(methanesulfonamido)-4-methylanilino]propanamide
CID 47079085
2-methyl-N-[4-[[1-(methylcarbamoylamino)-1-oxopropan-2-yl]amino]phenyl]propanamide
CID 51178190
2-[4-[(2-methoxyacetyl)amino]anilino]-N-(2-methylpropylcarbamoyl)propanamide
CID 55572485

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide?
The IUPAC name of 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide (CID 43083279) is 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide is CCNC(=O)NC(=O)C(C)Nc1ccc(NC(C)=O)cc1.
What is the InChIKey of 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide?
The InChIKey is VWVWURAIWPTKKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-4-15-14(21)18-13(20)9(2)16-11-5-7-12(8-6-11)17-10(3)19/h5-9,16H,4H2,1-3H3,(H,17,19)(H2,15,18,20,21).
What are the key properties of 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide?
2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide has a molecular weight of 292.34 g/mol, XLogP of 1.29, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 43083279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).