2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide

C14H24N4O3 — CID 3628865

IUPAC2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide
SMILESCCCCCCN(CC(=O)Nc1ccon1)C(=O)NCC
InChIInChI=1S/C14H24N4O3/c1-3-5-6-7-9-18(14(20)15-4-2)11-13(19)16-12-8-10-21-17-12/h8,10H,3-7,9,11H2,1-2H3,(H,15,20)(H,16,17,19)
InChIKeyONMYFKCXXYFJCP-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.22
Rot. Bonds9

About 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide

2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide (PubChem CID 3628865) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide
PubChem CID3628865
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC Name2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide
SMILESCCCCCCN(CC(=O)Nc1ccon1)C(=O)NCC
InChIInChI=1S/C14H24N4O3/c1-3-5-6-7-9-18(14(20)15-4-2)11-13(19)16-12-8-10-21-17-12/h8,10H,3-7,9,11H2,1-2H3,(H,15,20)(H,16,17,19)
InChIKeyONMYFKCXXYFJCP-UHFFFAOYSA-N
XLogP2.22
TPSA87.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[benzylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide
CID 42769290
N-hexyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]heptanamide
CID 42663984
N-butyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]nonanamide
CID 4075259
N-hexyl-2,2-dimethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]propanamide
CID 42769041
N-butyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]heptanamide
CID 42663973
4-butyl-N-hexyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide
CID 3705087
N-hexyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]cyclopropanecarboxamide
CID 5064786
2-[ethylcarbamoyl(pentyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 3516799
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide
CID 42664167
2,6-dimethoxy-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-pentylbenzamide
CID 42770937
N-(3-methoxypropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]heptanamide
CID 42771642
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-pentylthiophene-2-carboxamide
CID 4248802

Frequently Asked Questions

What is the IUPAC name of 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide (CID 3628865) is 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide is CCCCCCN(CC(=O)Nc1ccon1)C(=O)NCC.
What is the InChIKey of 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide?
The InChIKey is ONMYFKCXXYFJCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-3-5-6-7-9-18(14(20)15-4-2)11-13(19)16-12-8-10-21-17-12/h8,10H,3-7,9,11H2,1-2H3,(H,15,20)(H,16,17,19).
What are the key properties of 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide?
2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide has a molecular weight of 296.37 g/mol, XLogP of 2.22, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 3628865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).