2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide

C9H15N3O2 — CID 106371987

IUPAC2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide
SMILESCCC(NCc1ncc(C)o1)C(N)=O
InChIInChI=1S/C9H15N3O2/c1-3-7(9(10)13)11-5-8-12-4-6(2)14-8/h4,7,11H,3,5H2,1-2H3,(H2,10,13)
InChIKeyHCMUZGCACXETFY-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.34
Rot. Bonds5

About 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide

2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide (PubChem CID 106371987) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide.

Molecular Properties

Compound Name2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide
PubChem CID106371987
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide
SMILESCCC(NCc1ncc(C)o1)C(N)=O
InChIInChI=1S/C9H15N3O2/c1-3-7(9(10)13)11-5-8-12-4-6(2)14-8/h4,7,11H,3,5H2,1-2H3,(H2,10,13)
InChIKeyHCMUZGCACXETFY-UHFFFAOYSA-N
XLogP0.34
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]butanamide
CID 106371196
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
CID 103797047
ethyl 2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]butanoate
CID 106371541
(2R)-2-[(5-methyl-1,3-oxazol-2-yl)methylcarbamoylamino]butanoic acid
CID 106374415
N'-hydroxy-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]pentanimidamide
CID 106372805
2-methyl-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanoic acid
CID 106371994
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]-2-phenylacetic acid
CID 106373563
3-(aminomethyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pentanamide
CID 106371544
1-ethyl-3-[(5-methyl-1,3-oxazol-2-yl)methyl]urea
CID 103738715
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 83622965
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanediamide
CID 103827683
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-sulfanylpropanamide
CID 106377758

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide?
The IUPAC name of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide (CID 106371987) is 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide.
What is the SMILES notation for 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide?
The canonical SMILES for 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide is CCC(NCc1ncc(C)o1)C(N)=O.
What is the InChIKey of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide?
The InChIKey is HCMUZGCACXETFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-3-7(9(10)13)11-5-8-12-4-6(2)14-8/h4,7,11H,3,5H2,1-2H3,(H2,10,13).
What are the key properties of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide?
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide has a molecular weight of 197.24 g/mol, XLogP of 0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]butanamide is sourced from PubChem (CID 106371987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).