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

C15H26N2O2 — CID 65184626

IUPAC2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
SMILESCC(C)(C)NCCCc1ncc(C2CCOCC2)o1
InChIInChI=1S/C15H26N2O2/c1-15(2,3)17-8-4-5-14-16-11-13(19-14)12-6-9-18-10-7-12/h11-12,17H,4-10H2,1-3H3
InChIKeyDMTMWYIUKXHVBF-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.89
Rot. Bonds5

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

2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine (PubChem CID 65184626) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
PubChem CID65184626
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
SMILESCC(C)(C)NCCCc1ncc(C2CCOCC2)o1
InChIInChI=1S/C15H26N2O2/c1-15(2,3)17-8-4-5-14-16-11-13(19-14)12-6-9-18-10-7-12/h11-12,17H,4-10H2,1-3H3
InChIKeyDMTMWYIUKXHVBF-UHFFFAOYSA-N
XLogP2.89
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.89
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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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine (CID 65184626) is 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine is CC(C)(C)NCCCc1ncc(C2CCOCC2)o1.
What is the InChIKey of 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
The InChIKey is DMTMWYIUKXHVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-15(2,3)17-8-4-5-14-16-11-13(19-14)12-6-9-18-10-7-12/h11-12,17H,4-10H2,1-3H3.
What are the key properties of 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine has a molecular weight of 266.38 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine is sourced from PubChem (CID 65184626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).