N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine

C11H20N2O2 — CID 112605902

IUPACN-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ncoc1COC(C)C
InChIInChI=1S/C11H20N2O2/c1-8(2)12-5-10-11(15-7-13-10)6-14-9(3)4/h7-9,12H,5-6H2,1-4H3
InChIKeyYPUNANRFSUGZTJ-UHFFFAOYSA-N
MW212.29 g/mol
LogP2.10
Rot. Bonds6

About N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine

N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine (PubChem CID 112605902) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
PubChem CID112605902
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ncoc1COC(C)C
InChIInChI=1S/C11H20N2O2/c1-8(2)12-5-10-11(15-7-13-10)6-14-9(3)4/h7-9,12H,5-6H2,1-4H3
InChIKeyYPUNANRFSUGZTJ-UHFFFAOYSA-N
XLogP2.10
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[5-(propoxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 107943979
4-(bromomethyl)-5-(propan-2-yloxymethyl)-1,3-oxazole
CID 112605916
N-[[5-(cycloheptylmethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 114459416
N-[[5-[2-(oxolan-2-yl)ethyl]-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79145839
N-[[5-(3,5-dimethoxyphenyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79145454
N-[[5-(2,2,3,3-tetramethylcyclopropyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79145548
N-[(5-phenyl-1,3-oxazol-4-yl)methyl]propan-2-amine
CID 79145650
N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 114824033
N-[[5-(2-methoxyphenyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79146027
N-[[5-(oxan-4-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79145641
N-[[5-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79145453
N-[[5-(2,4,5-trimethyloxolan-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79145172

Frequently Asked Questions

What is the IUPAC name of N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine (CID 112605902) is N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine is CC(C)NCc1ncoc1COC(C)C.
What is the InChIKey of N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The InChIKey is YPUNANRFSUGZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-8(2)12-5-10-11(15-7-13-10)6-14-9(3)4/h7-9,12H,5-6H2,1-4H3.
What are the key properties of N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine has a molecular weight of 212.29 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(propan-2-yloxymethyl)-1,3-oxazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 112605902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).