N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine

C11H21N3O — CID 59777386

IUPACN-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine
SMILESCCc1noc(C[C@@H](C)NC(C)(C)C)n1
InChIInChI=1S/C11H21N3O/c1-6-9-12-10(15-14-9)7-8(2)13-11(3,4)5/h8,13H,6-7H2,1-5H3/t8-/m1/s1
InChIKeyQQWUJOJBKJMMAT-MRVPVSSYSA-N
MW211.31 g/mol
LogP1.95
Rot. Bonds4

About N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine

N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine (PubChem CID 59777386) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine
PubChem CID59777386
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine
SMILESCCc1noc(C[C@@H](C)NC(C)(C)C)n1
InChIInChI=1S/C11H21N3O/c1-6-9-12-10(15-14-9)7-8(2)13-11(3,4)5/h8,13H,6-7H2,1-5H3/t8-/m1/s1
InChIKeyQQWUJOJBKJMMAT-MRVPVSSYSA-N
XLogP1.95
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine?
The IUPAC name of N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine (CID 59777386) is N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine is CCc1noc(C[C@@H](C)NC(C)(C)C)n1.
What is the InChIKey of N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine?
The InChIKey is QQWUJOJBKJMMAT-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-6-9-12-10(15-14-9)7-8(2)13-11(3,4)5/h8,13H,6-7H2,1-5H3/t8-/m1/s1.
What are the key properties of N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine?
N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine has a molecular weight of 211.31 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(3-ethyl-1,2,4-oxadiazol-5-yl)propan-2-yl]-2-methylpropan-2-amine is sourced from PubChem (CID 59777386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).