(4R)-4-propyl-1,3-oxazinan-2-one

C7H13NO2 — CID 162410725

IUPAC(4R)-4-propyl-1,3-oxazinan-2-one
SMILESCCC[C@@H]1CCOC(=O)N1
InChIInChI=1S/C7H13NO2/c1-2-3-6-4-5-10-7(9)8-6/h6H,2-5H2,1H3,(H,8,9)/t6-/m1/s1
InChIKeyYLXOUGGMXAKQNG-ZCFIWIBFSA-N
MW143.19 g/mol
LogP1.28
Rot. Bonds2

About (4R)-4-propyl-1,3-oxazinan-2-one

(4R)-4-propyl-1,3-oxazinan-2-one (PubChem CID 162410725) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (4R)-4-propyl-1,3-oxazinan-2-one.

Molecular Properties

Compound Name(4R)-4-propyl-1,3-oxazinan-2-one
PubChem CID162410725
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(4R)-4-propyl-1,3-oxazinan-2-one
SMILESCCC[C@@H]1CCOC(=O)N1
InChIInChI=1S/C7H13NO2/c1-2-3-6-4-5-10-7(9)8-6/h6H,2-5H2,1H3,(H,8,9)/t6-/m1/s1
InChIKeyYLXOUGGMXAKQNG-ZCFIWIBFSA-N
XLogP1.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexyl-carbamic acid hexyl ester
CID 10998746
(4R)-4-methyl-1,3-oxazinan-2-one
CID 118600767
(4S)-4-methyl-1,3-oxazinan-2-one
CID 177801697
(4R)-4-[(1S)-1-fluoropropyl]-1,3-oxazinan-2-one
CID 134968378
(4R)-4-[(1S)-1-azidopropyl]-1,3-oxazinan-2-one
CID 16743675
(4S,5S)-5-methyl-4-propan-2-yl-1,3-oxazinan-2-one
CID 102164344
(4R)-4-[(1S)-1-chloropropyl]-1,3-oxazinan-2-one
CID 134968248
(4R)-4-[(2S)-butan-2-yl]-1,3-oxazinan-2-one
CID 134968305
(4R)-4-ethyl-1,3-oxazinan-2-one
CID 162410726
4-Methyl-1,3-oxazinan-2-one
CID 12202794
2-piperidin-2-ylethyl N-methylcarbamate
CID 20746159
4-Dodecyl-1,3-oxazinan-2-one
CID 22163711

Frequently Asked Questions

What is the IUPAC name of (4R)-4-propyl-1,3-oxazinan-2-one?
The IUPAC name of (4R)-4-propyl-1,3-oxazinan-2-one (CID 162410725) is (4R)-4-propyl-1,3-oxazinan-2-one.
What is the SMILES notation for (4R)-4-propyl-1,3-oxazinan-2-one?
The canonical SMILES for (4R)-4-propyl-1,3-oxazinan-2-one is CCC[C@@H]1CCOC(=O)N1.
What is the InChIKey of (4R)-4-propyl-1,3-oxazinan-2-one?
The InChIKey is YLXOUGGMXAKQNG-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H13NO2/c1-2-3-6-4-5-10-7(9)8-6/h6H,2-5H2,1H3,(H,8,9)/t6-/m1/s1.
What are the key properties of (4R)-4-propyl-1,3-oxazinan-2-one?
(4R)-4-propyl-1,3-oxazinan-2-one has a molecular weight of 143.19 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-propyl-1,3-oxazinan-2-one is sourced from PubChem (CID 162410725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).