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

C13H24N2O2 — CID 103022698

IUPACN-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
SMILESCOC(C)(C)Cc1cnc(CCNC(C)C)o1
InChIInChI=1S/C13H24N2O2/c1-10(2)14-7-6-12-15-9-11(17-12)8-13(3,4)16-5/h9-10,14H,6-8H2,1-5H3
InChIKeyWCDXEZVQXPPKEH-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.18
Rot. Bonds7

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

N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine (PubChem CID 103022698) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
PubChem CID103022698
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
SMILESCOC(C)(C)Cc1cnc(CCNC(C)C)o1
InChIInChI=1S/C13H24N2O2/c1-10(2)14-7-6-12-15-9-11(17-12)8-13(3,4)16-5/h9-10,14H,6-8H2,1-5H3
InChIKeyWCDXEZVQXPPKEH-UHFFFAOYSA-N
XLogP2.18
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
The IUPAC name of N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine (CID 103022698) is N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine.
What is the SMILES notation for N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
The canonical SMILES for N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine is COC(C)(C)Cc1cnc(CCNC(C)C)o1.
What is the InChIKey of N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
The InChIKey is WCDXEZVQXPPKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(2)14-7-6-12-15-9-11(17-12)8-13(3,4)16-5/h9-10,14H,6-8H2,1-5H3.
What are the key properties of N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine?
N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine has a molecular weight of 240.35 g/mol, XLogP of 2.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(2-methoxy-2-methylpropyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine is sourced from PubChem (CID 103022698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).