2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide

C16H19N3O2 — CID 119292951

IUPAC2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1
InChIInChI=1S/C16H19N3O2/c1-16(2,17)15(20)19-12-7-5-10(6-8-12)13-9-18-14(21-13)11-3-4-11/h5-9,11H,3-4,17H2,1-2H3,(H,19,20)
InChIKeyXTTUUFAAGBFFBX-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.89
Rot. Bonds4

About 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide

2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide (PubChem CID 119292951) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide
PubChem CID119292951
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1
InChIInChI=1S/C16H19N3O2/c1-16(2,17)15(20)19-12-7-5-10(6-8-12)13-9-18-14(21-13)11-3-4-11/h5-9,11H,3-4,17H2,1-2H3,(H,19,20)
InChIKeyXTTUUFAAGBFFBX-UHFFFAOYSA-N
XLogP2.89
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide (CID 119292951) is 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide is CC(C)(N)C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1.
What is the InChIKey of 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide?
The InChIKey is XTTUUFAAGBFFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-16(2,17)15(20)19-12-7-5-10(6-8-12)13-9-18-14(21-13)11-3-4-11/h5-9,11H,3-4,17H2,1-2H3,(H,19,20).
What are the key properties of 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide?
2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide has a molecular weight of 285.35 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(2-cyclopropyl-1,3-oxazol-5-yl)phenyl]-2-methylpropanamide is sourced from PubChem (CID 119292951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).