N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide

C22H39N3O3 — CID 42664167

IUPACN-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide
SMILESCCCCCCCCCCCCCC(=O)N(CCC)CC(=O)Nc1ccon1
InChIInChI=1S/C22H39N3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-22(27)25(17-4-2)19-21(26)23-20-16-18-28-24-20/h16,18H,3-15,17,19H2,1-2H3,(H,23,24,26)
InChIKeyTUQWJLXTHKAICR-UHFFFAOYSA-N
MW393.57 g/mol
LogP5.55
Rot. Bonds17

About N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide

N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide (PubChem CID 42664167) has the molecular formula C22H39N3O3 and a molecular weight of 393.57 g/mol. Its IUPAC name is N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide.

Molecular Properties

Compound NameN-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide
PubChem CID42664167
Molecular FormulaC22H39N3O3
Molecular Weight393.57 g/mol
Exact Mass393.30
IUPAC NameN-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide
SMILESCCCCCCCCCCCCCC(=O)N(CCC)CC(=O)Nc1ccon1
InChIInChI=1S/C22H39N3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-22(27)25(17-4-2)19-21(26)23-20-16-18-28-24-20/h16,18H,3-15,17,19H2,1-2H3,(H,23,24,26)
InChIKeyTUQWJLXTHKAICR-UHFFFAOYSA-N
XLogP5.55
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.57
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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-butyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]heptanamide
CID 42663973
N-(2-methoxyethyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]nonanamide
CID 5176062
N-(3-methoxypropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]heptanamide
CID 42771642
N-(3-ethoxypropyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]hexanamide
CID 4080850
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-prop-2-enylheptanamide
CID 42769068
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-(2-pyrrolidin-1-ylethyl)nonanamide
CID 4582164
N-(2-methoxyethyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]pentanamide
CID 42769137
N-(cyclohexylmethyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]nonanamide
CID 3517609
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propan-2-yloctanamide
CID 42769111
2-[ethylcarbamoyl(hexyl)amino]-N-(1,2-oxazol-3-yl)acetamide
CID 3628865

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide?
The IUPAC name of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide (CID 42664167) is N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide.
What is the SMILES notation for N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide?
The canonical SMILES for N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide is CCCCCCCCCCCCCC(=O)N(CCC)CC(=O)Nc1ccon1.
What is the InChIKey of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide?
The InChIKey is TUQWJLXTHKAICR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H39N3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-22(27)25(17-4-2)19-21(26)23-20-16-18-28-24-20/h16,18H,3-15,17,19H2,1-2H3,(H,23,24,26).
What are the key properties of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide?
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide has a molecular weight of 393.57 g/mol, XLogP of 5.55, 17 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide is sourced from PubChem (CID 42664167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).