(3R)-5-methoxy-3-(methylamino)pentan-2-one

C7H15NO2 — CID 130319211

IUPAC(3R)-5-methoxy-3-(methylamino)pentan-2-one
SMILESCN[C@H](CCOC)C(C)=O
InChIInChI=1S/C7H15NO2/c1-6(9)7(8-2)4-5-10-3/h7-8H,4-5H2,1-3H3/t7-/m1/s1
InChIKeyFIFQINGIJGUJIK-SSDOTTSWSA-N
MW145.20 g/mol
LogP0.20
Rot. Bonds5

About (3R)-5-methoxy-3-(methylamino)pentan-2-one

(3R)-5-methoxy-3-(methylamino)pentan-2-one (PubChem CID 130319211) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is (3R)-5-methoxy-3-(methylamino)pentan-2-one.

Molecular Properties

Compound Name(3R)-5-methoxy-3-(methylamino)pentan-2-one
PubChem CID130319211
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name(3R)-5-methoxy-3-(methylamino)pentan-2-one
SMILESCN[C@H](CCOC)C(C)=O
InChIInChI=1S/C7H15NO2/c1-6(9)7(8-2)4-5-10-3/h7-8H,4-5H2,1-3H3/t7-/m1/s1
InChIKeyFIFQINGIJGUJIK-SSDOTTSWSA-N
XLogP0.20
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-5-methyl-3-(methylamino)heptan-2-one
CID 163447432
(3S)-5-hydroxy-3-(methylamino)pentan-2-one
CID 59960243
(3S)-3-(methylamino)-5-sulfanylpentan-2-one
CID 88948174
5-amino-3-(methylamino)pentan-2-one;methane
CID 157156675
(3S)-3-(methylamino)-5-[[(2R)-2-(methylamino)-3-oxobutyl]disulfanyl]pentan-2-one
CID 170273125
2-methoxy-N-[5-(methylamino)-6-oxoheptyl]acetamide
CID 159874628
(3S,6E)-6-methoxyimino-3-(methylamino)octan-2-one
CID 172944980
(3R)-6-amino-6-hydroxy-3-(methylamino)hexan-2-one
CID 167006096
(3S)-6-amino-3-(methylamino)hexan-2-one
CID 59098893
6-hydroxy-3-(methylamino)hept-6-en-2-one
CID 58339043
3-(methylamino)nonan-2-one
CID 21024660
methyl-[3-(methylamino)-4-oxopentyl]-oxophosphanium
CID 159074240

Frequently Asked Questions

What is the IUPAC name of (3R)-5-methoxy-3-(methylamino)pentan-2-one?
The IUPAC name of (3R)-5-methoxy-3-(methylamino)pentan-2-one (CID 130319211) is (3R)-5-methoxy-3-(methylamino)pentan-2-one.
What is the SMILES notation for (3R)-5-methoxy-3-(methylamino)pentan-2-one?
The canonical SMILES for (3R)-5-methoxy-3-(methylamino)pentan-2-one is CN[C@H](CCOC)C(C)=O.
What is the InChIKey of (3R)-5-methoxy-3-(methylamino)pentan-2-one?
The InChIKey is FIFQINGIJGUJIK-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H15NO2/c1-6(9)7(8-2)4-5-10-3/h7-8H,4-5H2,1-3H3/t7-/m1/s1.
What are the key properties of (3R)-5-methoxy-3-(methylamino)pentan-2-one?
(3R)-5-methoxy-3-(methylamino)pentan-2-one has a molecular weight of 145.20 g/mol, XLogP of 0.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-methoxy-3-(methylamino)pentan-2-one is sourced from PubChem (CID 130319211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).