N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine

C13H17N3O2 — CID 113377918

IUPACN-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCc1ccc(Oc2nc(CNC(C)C)co2)cn1
InChIInChI=1S/C13H17N3O2/c1-9(2)14-6-11-8-17-13(16-11)18-12-5-4-10(3)15-7-12/h4-5,7-9,14H,6H2,1-3H3
InChIKeyFPBNYFNANDYVEH-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.67
Rot. Bonds5

About N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine

N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine (PubChem CID 113377918) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
PubChem CID113377918
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC NameN-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
SMILESCc1ccc(Oc2nc(CNC(C)C)co2)cn1
InChIInChI=1S/C13H17N3O2/c1-9(2)14-6-11-8-17-13(16-11)18-12-5-4-10(3)15-7-12/h4-5,7-9,14H,6H2,1-3H3
InChIKeyFPBNYFNANDYVEH-UHFFFAOYSA-N
XLogP2.67
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]methyl]propan-2-amine
CID 66451348
N-[[2-[(2-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113378081
N-[[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 103175462
N-[[4-[(6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methyl]propan-2-amine
CID 62287531
N-[[2-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113378085
N-[[4-methyl-2-[(6-methyl-3-pyridinyl)oxy]pyrimidin-5-yl]methyl]propan-2-amine
CID 83189037
N-[[2-[(6-methyl-3-pyridinyl)oxy]-4-pyridinyl]methyl]propan-2-amine
CID 62288406
N-[[5-[(6-methyl-3-pyridinyl)oxy]-1,3,4-thiadiazol-2-yl]methyl]propan-2-amine
CID 80624545
N-[[2-(5-bromo-2-fluorophenoxy)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 114676722
N-[[6-[(6-methyl-3-pyridinyl)oxy]imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 62074983
1-[2-(2,3-dihydro-1H-inden-5-yloxy)-1,3-oxazol-4-yl]-N-methylmethanamine
CID 113378023
N-[[2-(oxan-4-ylmethoxy)-1,3-oxazol-4-yl]methyl]propan-2-amine
CID 113378047

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine (CID 113377918) is N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine is Cc1ccc(Oc2nc(CNC(C)C)co2)cn1.
What is the InChIKey of N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine?
The InChIKey is FPBNYFNANDYVEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-9(2)14-6-11-8-17-13(16-11)18-12-5-4-10(3)15-7-12/h4-5,7-9,14H,6H2,1-3H3.
What are the key properties of N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine?
N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine has a molecular weight of 247.30 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(6-methyl-3-pyridinyl)oxy]-1,3-oxazol-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 113377918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).