(5R)-1-ethyl-5-methoxypiperidin-2-one

C8H15NO2 — CID 170617785

IUPAC(5R)-1-ethyl-5-methoxypiperidin-2-one
SMILESCCN1C[C@H](OC)CCC1=O
InChIInChI=1S/C8H15NO2/c1-3-9-6-7(11-2)4-5-8(9)10/h7H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyPUSXYGZKSGUYFR-SSDOTTSWSA-N
MW157.21 g/mol
LogP0.64
Rot. Bonds2

About (5R)-1-ethyl-5-methoxypiperidin-2-one

(5R)-1-ethyl-5-methoxypiperidin-2-one (PubChem CID 170617785) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (5R)-1-ethyl-5-methoxypiperidin-2-one.

Molecular Properties

Compound Name(5R)-1-ethyl-5-methoxypiperidin-2-one
PubChem CID170617785
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(5R)-1-ethyl-5-methoxypiperidin-2-one
SMILESCCN1C[C@H](OC)CCC1=O
InChIInChI=1S/C8H15NO2/c1-3-9-6-7(11-2)4-5-8(9)10/h7H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyPUSXYGZKSGUYFR-SSDOTTSWSA-N
XLogP0.64
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxy-1-methylazepan-2-one
CID 59421614
methyl 1-ethyl-5-oxopyrrolidine-2-carboxylate
CID 67459237
methyl (3S)-1-ethyl-5-oxopyrrolidine-3-carboxylate
CID 42579819
1-ethyl-5-(piperazin-1-ylmethyl)piperidin-2-one
CID 82509807
CID 160939714
CID 160939714
(5R)-1-ethyl-5-methylpyrrolidin-2-one
CID 122427829
3-methoxycyclopentan-1-one;molecular hydrogen
CID 142607511
methyl 1-(2-methoxyethyl)-6-oxopiperidine-3-carboxylate
CID 102569899
3-ethyl-9-methyl-3,9-diazabicyclo[4.2.1]nonan-4-one
CID 557465
(4R)-4-methoxy-1-methylpiperidin-2-one
CID 118584700
1-ethyl-5-methylpiperidine-2,4-dione
CID 14800179
5-[(3-methoxycyclobutyl)amino]-1-methylpiperidin-2-one
CID 104871603

Frequently Asked Questions

What is the IUPAC name of (5R)-1-ethyl-5-methoxypiperidin-2-one?
The IUPAC name of (5R)-1-ethyl-5-methoxypiperidin-2-one (CID 170617785) is (5R)-1-ethyl-5-methoxypiperidin-2-one.
What is the SMILES notation for (5R)-1-ethyl-5-methoxypiperidin-2-one?
The canonical SMILES for (5R)-1-ethyl-5-methoxypiperidin-2-one is CCN1C[C@H](OC)CCC1=O.
What is the InChIKey of (5R)-1-ethyl-5-methoxypiperidin-2-one?
The InChIKey is PUSXYGZKSGUYFR-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-9-6-7(11-2)4-5-8(9)10/h7H,3-6H2,1-2H3/t7-/m1/s1.
What are the key properties of (5R)-1-ethyl-5-methoxypiperidin-2-one?
(5R)-1-ethyl-5-methoxypiperidin-2-one has a molecular weight of 157.21 g/mol, XLogP of 0.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-ethyl-5-methoxypiperidin-2-one is sourced from PubChem (CID 170617785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).