(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine

C15H16N4O — CID 104901602

IUPAC(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
SMILESCC(C)[C@@H](N)c1nc(-c2ccc3ncccc3c2)no1
InChIInChI=1S/C15H16N4O/c1-9(2)13(16)15-18-14(19-20-15)11-5-6-12-10(8-11)4-3-7-17-12/h3-9,13H,16H2,1-2H3/t13-/m1/s1
InChIKeyRAIVSSQIQIYSEM-CYBMUJFWSA-N
MW268.32 g/mol
LogP2.94
Rot. Bonds3

About (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine

(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine (PubChem CID 104901602) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine.

Molecular Properties

Compound Name(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
PubChem CID104901602
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
SMILESCC(C)[C@@H](N)c1nc(-c2ccc3ncccc3c2)no1
InChIInChI=1S/C15H16N4O/c1-9(2)13(16)15-18-14(19-20-15)11-5-6-12-10(8-11)4-3-7-17-12/h3-9,13H,16H2,1-2H3/t13-/m1/s1
InChIKeyRAIVSSQIQIYSEM-CYBMUJFWSA-N
XLogP2.94
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine with MolForge

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Related Compounds

(1S)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 104900102
1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)ethanol
CID 63349181
(1S)-2-methyl-1-(3-quinoxalin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 104901617
2-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 63095950
2-amino-2-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)ethanol
CID 63097003
2-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 65221531
(1R)-1-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylpropan-1-amine
CID 104901533
2-methyl-1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 43096854
3-[5-[(1R)-1-amino-2-methylpropyl]-1,2,4-oxadiazol-3-yl]phenol
CID 96810008
2-methyl-1-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 43625121
2-methyl-1-(3-naphthalen-2-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 62715364
3-(3-naphthalen-2-yl-1,2,4-oxadiazol-5-yl)butan-2-amine
CID 63351950

Frequently Asked Questions

What is the IUPAC name of (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine?
The IUPAC name of (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine (CID 104901602) is (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine.
What is the SMILES notation for (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine?
The canonical SMILES for (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine is CC(C)[C@@H](N)c1nc(-c2ccc3ncccc3c2)no1.
What is the InChIKey of (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine?
The InChIKey is RAIVSSQIQIYSEM-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H16N4O/c1-9(2)13(16)15-18-14(19-20-15)11-5-6-12-10(8-11)4-3-7-17-12/h3-9,13H,16H2,1-2H3/t13-/m1/s1.
What are the key properties of (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine?
(1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine has a molecular weight of 268.32 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)propan-1-amine is sourced from PubChem (CID 104901602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).