2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide

C8H12N2O3 — CID 131132198

IUPAC2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide
SMILESCCC(O)C(=O)Nc1cc(C)no1
InChIInChI=1S/C8H12N2O3/c1-3-6(11)8(12)9-7-4-5(2)10-13-7/h4,6,11H,3H2,1-2H3,(H,9,12)
InChIKeyBGABTNBAAJYYDD-UHFFFAOYSA-N
MW184.19 g/mol
LogP0.69
Rot. Bonds3

About 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide

2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide (PubChem CID 131132198) has the molecular formula C8H12N2O3 and a molecular weight of 184.19 g/mol. Its IUPAC name is 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide.

Molecular Properties

Compound Name2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide
PubChem CID131132198
Molecular FormulaC8H12N2O3
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC Name2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide
SMILESCCC(O)C(=O)Nc1cc(C)no1
InChIInChI=1S/C8H12N2O3/c1-3-6(11)8(12)9-7-4-5(2)10-13-7/h4,6,11H,3H2,1-2H3,(H,9,12)
InChIKeyBGABTNBAAJYYDD-UHFFFAOYSA-N
XLogP0.69
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-chloro-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 40953774
N-(3-methyl-1,2-oxazol-5-yl)carbamate
CID 22936595
2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxoacetic acid
CID 43444914
2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 110019829
N-(3-methyl-1,2-oxazol-5-yl)prop-2-enamide
CID 43616283
(2S)-2-amino-3-(4-hydroxyphenyl)-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 61148539
methyl 2-[1-[(3-methyl-1,2-oxazol-5-yl)amino]-1-oxopropan-2-yl]sulfanylpropanoate
CID 78842879
2-cyano-2-ethyl-N-(3-methyl-1,2-oxazol-5-yl)butanamide
CID 55207137
2-(2,3-dihydroxypropylsulfanyl)-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 79682116
4-(ethylamino)-N-(3-methyl-1,2-oxazol-5-yl)benzamide
CID 62184915
1-(2-hydroxyethylamino)-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 90203017
4-amino-3-methyl-N-(3-methyl-1,2-oxazol-5-yl)butanamide
CID 81071258

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide?
The IUPAC name of 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide (CID 131132198) is 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide.
What is the SMILES notation for 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide?
The canonical SMILES for 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide is CCC(O)C(=O)Nc1cc(C)no1.
What is the InChIKey of 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide?
The InChIKey is BGABTNBAAJYYDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-3-6(11)8(12)9-7-4-5(2)10-13-7/h4,6,11H,3H2,1-2H3,(H,9,12).
What are the key properties of 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide?
2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide has a molecular weight of 184.19 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(3-methyl-1,2-oxazol-5-yl)butanamide is sourced from PubChem (CID 131132198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).