N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine

C15H28N2O2 — CID 103022713

IUPACN-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
SMILESCOC(C)(C)Cc1cnc(CCCNCC(C)C)o1
InChIInChI=1S/C15H28N2O2/c1-12(2)10-16-8-6-7-14-17-11-13(19-14)9-15(3,4)18-5/h11-12,16H,6-10H2,1-5H3
InChIKeyBIXQIDUWJOKVHF-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.82
Rot. Bonds9

About N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine

N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine (PubChem CID 103022713) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
PubChem CID103022713
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
SMILESCOC(C)(C)Cc1cnc(CCCNCC(C)C)o1
InChIInChI=1S/C15H28N2O2/c1-12(2)10-16-8-6-7-14-17-11-13(19-14)9-15(3,4)18-5/h11-12,16H,6-10H2,1-5H3
InChIKeyBIXQIDUWJOKVHF-UHFFFAOYSA-N
XLogP2.82
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.82
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

N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 103022698
N-ethyl-2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethanamine
CID 103022695
2-methyl-N-[3-[5-(2,2,2-trifluoroethoxymethyl)-1,3-oxazol-2-yl]propyl]propan-1-amine
CID 103213243
2-methyl-N-[3-[5-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3-oxazol-2-yl]propyl]propan-1-amine
CID 103213242
2-methyl-N-[3-(5-propan-2-yl-1,3-oxazol-2-yl)propyl]propan-1-amine
CID 65185038
2-methyl-N-[2-[5-(3-methylbutyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 65182651
1-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 103022672
3-[5-(2,2-dimethylpropyl)-1,3-oxazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 65187329
N-[3-[5-(5-bromofuran-2-yl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
CID 65184690
2-methyl-N-[3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propyl]propan-1-amine
CID 65184743
2-methyl-N-[3-[5-(5-methyloxolan-2-yl)-1,3-oxazol-2-yl]propyl]propan-1-amine
CID 81327217
N-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
CID 65185138

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine?
The IUPAC name of N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine (CID 103022713) is N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine is COC(C)(C)Cc1cnc(CCCNCC(C)C)o1.
What is the InChIKey of N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine?
The InChIKey is BIXQIDUWJOKVHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(2)10-16-8-6-7-14-17-11-13(19-14)9-15(3,4)18-5/h11-12,16H,6-10H2,1-5H3.
What are the key properties of N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine?
N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 2.82, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine is sourced from PubChem (CID 103022713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).