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

C10H17N3O2 — CID 103811586

IUPAC4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
SMILESCNCCCC(=O)NCc1ncc(C)o1
InChIInChI=1S/C10H17N3O2/c1-8-6-13-10(15-8)7-12-9(14)4-3-5-11-2/h6,11H,3-5,7H2,1-2H3,(H,12,14)
InChIKeyDRVUKXSJKPMGTH-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.60
Rot. Bonds6

About 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide

4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide (PubChem CID 103811586) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide.

Molecular Properties

Compound Name4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
PubChem CID103811586
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
SMILESCNCCCC(=O)NCc1ncc(C)o1
InChIInChI=1S/C10H17N3O2/c1-8-6-13-10(15-8)7-12-9(14)4-3-5-11-2/h6,11H,3-5,7H2,1-2H3,(H,12,14)
InChIKeyDRVUKXSJKPMGTH-UHFFFAOYSA-N
XLogP0.60
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371442
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 83622965
4-amino-4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pentanamide
CID 103811604
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-3-(4-methylphenyl)propanamide
CID 110660397
3-(4-aminophenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106368624
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-phenylacetamide
CID 110660350
2-(tert-butylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 103726080
3-chloro-N-[(5-methyl-1,3-oxazol-2-yl)methylcarbamoyl]propanamide
CID 106375343
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-(2-methylphenyl)acetamide
CID 110660403
3-amino-3-hydroxyimino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106375701
4-amino-3-methoxy-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
CID 107093435
1-ethyl-3-[(5-methyl-1,3-oxazol-2-yl)methyl]urea
CID 103738715

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide?
The IUPAC name of 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide (CID 103811586) is 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide.
What is the SMILES notation for 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide?
The canonical SMILES for 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide is CNCCCC(=O)NCc1ncc(C)o1.
What is the InChIKey of 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide?
The InChIKey is DRVUKXSJKPMGTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-8-6-13-10(15-8)7-12-9(14)4-3-5-11-2/h6,11H,3-5,7H2,1-2H3,(H,12,14).
What are the key properties of 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide?
4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide has a molecular weight of 211.26 g/mol, XLogP of 0.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide is sourced from PubChem (CID 103811586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).