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

C13H18N2O2 — CID 114824037

IUPAC2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCc1cc(-c2ocnc2CNC(C)(C)C)co1
InChIInChI=1S/C13H18N2O2/c1-9-5-10(7-16-9)12-11(14-8-17-12)6-15-13(2,3)4/h5,7-8,15H,6H2,1-4H3
InChIKeyVINOLZNDLZTXBA-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.13
Rot. Bonds3

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

2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine (PubChem CID 114824037) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
PubChem CID114824037
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCc1cc(-c2ocnc2CNC(C)(C)C)co1
InChIInChI=1S/C13H18N2O2/c1-9-5-10(7-16-9)12-11(14-8-17-12)6-15-13(2,3)4/h5,7-8,15H,6H2,1-4H3
InChIKeyVINOLZNDLZTXBA-UHFFFAOYSA-N
XLogP3.13
TPSA51.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

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Related Compounds

N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]ethanamine
CID 114824029
N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 114824033
N-[[5-(4-fluoro-3-methylphenyl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 79145569
N-[[5-(2,5-dimethylphenyl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 79146041
2-methyl-N-[[5-(4-methylthiophen-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79818496
N-[[5-(2,5-dimethylpyrazol-3-yl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 79145010
2-methyl-N-[[5-(2-methylsulfanylphenyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79212909
N-[[5-(3-chlorothiophen-2-yl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 80642061
N-[[5-(5-chloro-2-methoxyphenyl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 79145577
2-methyl-N-[[5-(2-methylcyclopropyl)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 79146142
N-[[5-(2,3-dihydro-1,4-benzodioxin-5-yl)-1,3-oxazol-4-yl]methyl]-2-methylpropan-2-amine
CID 79148545
N-[[5-(4-tert-butylphenyl)-1,3-oxazol-4-yl]methyl]-2-methoxyethanamine
CID 79148265

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine (CID 114824037) is 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine is Cc1cc(-c2ocnc2CNC(C)(C)C)co1.
What is the InChIKey of 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
The InChIKey is VINOLZNDLZTXBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-5-10(7-16-9)12-11(14-8-17-12)6-15-13(2,3)4/h5,7-8,15H,6H2,1-4H3.
What are the key properties of 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine?
2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine has a molecular weight of 234.30 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[5-(5-methylfuran-3-yl)-1,3-oxazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 114824037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).