N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine

C10H18N2O2 — CID 106372348

IUPACN-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine
SMILESCCCOCCNCc1ncc(C)o1
InChIInChI=1S/C10H18N2O2/c1-3-5-13-6-4-11-8-10-12-7-9(2)14-10/h7,11H,3-6,8H2,1-2H3
InChIKeyZLTODCAXSLZXHL-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.50
Rot. Bonds7

About N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine (PubChem CID 106372348) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine.

Molecular Properties

Compound NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine
PubChem CID106372348
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine
SMILESCCCOCCNCc1ncc(C)o1
InChIInChI=1S/C10H18N2O2/c1-3-5-13-6-4-11-8-10-12-7-9(2)14-10/h7,11H,3-6,8H2,1-2H3
InChIKeyZLTODCAXSLZXHL-UHFFFAOYSA-N
XLogP1.50
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 106372226
2-methoxy-N-[(5-methyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 65181879
3-(2-methoxyethoxy)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propan-1-amine
CID 106372373
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-1-ol
CID 106371738
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-propoxyethanamine
CID 106451759
1-[(5-methyl-1,3-oxazol-2-yl)methylamino]-3-octoxypropan-2-ol
CID 106371765
1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275583
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-(4-nitrophenoxy)ethanamine
CID 106372327
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-pyridin-4-ylethanamine
CID 106372261
N-butyl-2-[(5-methyl-1,3-oxazol-2-yl)methylamino]acetamide
CID 106372322
N-[(5,6-dimethyl-3-pyridinyl)methyl]-2-propoxyethanamine;propane
CID 143263226
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]acetic acid
CID 106372016

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine?
The IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine (CID 106372348) is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine.
What is the SMILES notation for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine?
The canonical SMILES for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine is CCCOCCNCc1ncc(C)o1.
What is the InChIKey of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine?
The InChIKey is ZLTODCAXSLZXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-3-5-13-6-4-11-8-10-12-7-9(2)14-10/h7,11H,3-6,8H2,1-2H3.
What are the key properties of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine?
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine has a molecular weight of 198.27 g/mol, XLogP of 1.50, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propoxyethanamine is sourced from PubChem (CID 106372348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).