3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide

C15H26N2O3 — CID 109379793

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide
SMILESCCN(CC(C)(C)O)C(=O)CC(C)c1c(C)noc1C
InChIInChI=1S/C15H26N2O3/c1-7-17(9-15(5,6)19)13(18)8-10(2)14-11(3)16-20-12(14)4/h10,19H,7-9H2,1-6H3
InChIKeyLTPMBUJMSBYUCI-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.40
Rot. Bonds6

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide (PubChem CID 109379793) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide
PubChem CID109379793
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide
SMILESCCN(CC(C)(C)O)C(=O)CC(C)c1c(C)noc1C
InChIInChI=1S/C15H26N2O3/c1-7-17(9-15(5,6)19)13(18)8-10(2)14-11(3)16-20-12(14)4/h10,19H,7-9H2,1-6H3
InChIKeyLTPMBUJMSBYUCI-UHFFFAOYSA-N
XLogP2.40
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-methylbutanamide
CID 79387562
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-hydroxy-2,3-dimethylbutyl)butanamide
CID 109379753
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-ethyl-2-hydroxybutyl)butanamide
CID 109379728
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
CID 110000893
2-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]-N,N-diethylpropanamide
CID 78961648
3-cyano-3-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dipropylpropanamide
CID 82139200
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-hydroxy-3-methylpentyl)butanamide
CID 109380177
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-hydroxypropyl)butanamide
CID 109378471
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-one
CID 136534661
4-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-methoxybutanamide
CID 103156201
2-[4-[[3-(3,5-dimethyl-1,2-oxazol-4-yl)butanoyl-methylamino]methyl]phenoxy]acetic acid
CID 120538107
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide
CID 154739445

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide (CID 109379793) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide is CCN(CC(C)(C)O)C(=O)CC(C)c1c(C)noc1C.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide?
The InChIKey is LTPMBUJMSBYUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-7-17(9-15(5,6)19)13(18)8-10(2)14-11(3)16-20-12(14)4/h10,19H,7-9H2,1-6H3.
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide has a molecular weight of 282.38 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)butanamide is sourced from PubChem (CID 109379793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).