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

C15H21N3O2 — CID 124505843

IUPAC(2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
SMILESCOc1ccccc1C[C@@H](C)N(C)Cc1nnc(C)o1
InChIInChI=1S/C15H21N3O2/c1-11(9-13-7-5-6-8-14(13)19-4)18(3)10-15-17-16-12(2)20-15/h5-8,11H,9-10H2,1-4H3/t11-/m1/s1
InChIKeyROFKSQQPHBDPBX-LLVKDONJSA-N
MW275.35 g/mol
LogP2.45
Rot. Bonds6

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

(2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine (PubChem CID 124505843) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
PubChem CID124505843
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
SMILESCOc1ccccc1C[C@@H](C)N(C)Cc1nnc(C)o1
InChIInChI=1S/C15H21N3O2/c1-11(9-13-7-5-6-8-14(13)19-4)18(3)10-15-17-16-12(2)20-15/h5-8,11H,9-10H2,1-4H3/t11-/m1/s1
InChIKeyROFKSQQPHBDPBX-LLVKDONJSA-N
XLogP2.45
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine with MolForge

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Related Compounds

N-[(4-iodophenyl)methyl]-1-(2-methoxyphenyl)-N-methylpropan-2-amine
CID 65486312
1-(2-bromophenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]butan-2-amine
CID 122141633
5-[[1-(2-methoxyphenyl)propan-2-yl-methylamino]methyl]pyridin-2-amine
CID 115984767
(2R)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-1-(4-methyl-2-pyridinyl)propan-2-amine
CID 124752794
1-N-[1-(2-methoxyphenyl)propan-2-yl]-1-N-methylbutane-1,2-diamine
CID 65487594
3-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanenitrile
CID 65487029
5-[1-(2-methoxyphenyl)propan-2-yl-methylamino]pentan-1-ol
CID 65486301
N'-[1-(2-methoxyphenyl)propan-2-yl]-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 65486907
4-chloro-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylbut-2-en-1-amine
CID 77070468
1-N-[1-(2-methoxyphenyl)propan-2-yl]-1-N,2,2-trimethylbutane-1,3-diamine
CID 66454325
4-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-methylbutan-2-ol
CID 79361996
3-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methyl-3-sulfanylidenepropanamide
CID 65486697

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
The IUPAC name of (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine (CID 124505843) is (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine.
What is the SMILES notation for (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
The canonical SMILES for (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine is COc1ccccc1C[C@@H](C)N(C)Cc1nnc(C)o1.
What is the InChIKey of (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
The InChIKey is ROFKSQQPHBDPBX-LLVKDONJSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11(9-13-7-5-6-8-14(13)19-4)18(3)10-15-17-16-12(2)20-15/h5-8,11H,9-10H2,1-4H3/t11-/m1/s1.
What are the key properties of (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine?
(2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine has a molecular weight of 275.35 g/mol, XLogP of 2.45, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-methoxyphenyl)-N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 124505843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).