2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide

C14H25N3O3 — CID 111431870

IUPAC2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide
SMILESCCCCC(C(=O)Nc1cc(C)on1)N(CC)CCO
InChIInChI=1S/C14H25N3O3/c1-4-6-7-12(17(5-2)8-9-18)14(19)15-13-10-11(3)20-16-13/h10,12,18H,4-9H2,1-3H3,(H,15,16,19)
InChIKeyQLZWMSMGEMUZBT-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.79
Rot. Bonds9

About 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide

2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide (PubChem CID 111431870) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide.

Molecular Properties

Compound Name2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide
PubChem CID111431870
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide
SMILESCCCCC(C(=O)Nc1cc(C)on1)N(CC)CCO
InChIInChI=1S/C14H25N3O3/c1-4-6-7-12(17(5-2)8-9-18)14(19)15-13-10-11(3)20-16-13/h10,12,18H,4-9H2,1-3H3,(H,15,16,19)
InChIKeyQLZWMSMGEMUZBT-UHFFFAOYSA-N
XLogP1.79
TPSA78.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-hydroxyethyl(pentyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 111120306
3-[2-hydroxyethyl(pentan-3-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 62015887
(2S)-2-methyl-N-(5-methyl-1,2-oxazol-3-yl)pentanamide
CID 670809
N'-ethyl-N'-(2-hydroxyethyl)-N-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 47263973
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide
CID 111543682
N-butyl-2-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]propanamide
CID 24715040
(2S)-2-amino-N-(5-methyl-1,2-oxazol-3-yl)butanamide
CID 79024953
2-[hexyl(methylsulfonyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 3404528
N-(2-ethylhexyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 47205589
(2S)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide
CID 40792069
2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide
CID 17441380
N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-pentylpropanamide
CID 24715041

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide?
The IUPAC name of 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide (CID 111431870) is 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide.
What is the SMILES notation for 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide?
The canonical SMILES for 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide is CCCCC(C(=O)Nc1cc(C)on1)N(CC)CCO.
What is the InChIKey of 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide?
The InChIKey is QLZWMSMGEMUZBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-4-6-7-12(17(5-2)8-9-18)14(19)15-13-10-11(3)20-16-13/h10,12,18H,4-9H2,1-3H3,(H,15,16,19).
What are the key properties of 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide?
2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide has a molecular weight of 283.37 g/mol, XLogP of 1.79, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(2-hydroxyethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)hexanamide is sourced from PubChem (CID 111431870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).