3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide

C10H16N2O2 — CID 110679159

IUPAC3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide
SMILESCc1nc(CCC(=O)NC(C)C)co1
InChIInChI=1S/C10H16N2O2/c1-7(2)11-10(13)5-4-9-6-14-8(3)12-9/h6-7H,4-5H2,1-3H3,(H,11,13)
InChIKeyNIIPSRVKSIMFLA-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.44
Rot. Bonds4

About 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide

3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide (PubChem CID 110679159) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide
PubChem CID110679159
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide
SMILESCc1nc(CCC(=O)NC(C)C)co1
InChIInChI=1S/C10H16N2O2/c1-7(2)11-10(13)5-4-9-6-14-8(3)12-9/h6-7H,4-5H2,1-3H3,(H,11,13)
InChIKeyNIIPSRVKSIMFLA-UHFFFAOYSA-N
XLogP1.44
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide (CID 110679159) is 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide is Cc1nc(CCC(=O)NC(C)C)co1.
What is the InChIKey of 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide?
The InChIKey is NIIPSRVKSIMFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(2)11-10(13)5-4-9-6-14-8(3)12-9/h6-7H,4-5H2,1-3H3,(H,11,13).
What are the key properties of 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide?
3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide has a molecular weight of 196.25 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 110679159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).