cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone

C10H17NO2 — CID 110739832

IUPACcyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone
SMILESCC1OCCCN1C(=O)C1CCC1
InChIInChI=1S/C10H17NO2/c1-8-11(6-3-7-13-8)10(12)9-4-2-5-9/h8-9H,2-7H2,1H3
InChIKeyFDUAFHFQEIOJHD-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.38
Rot. Bonds1

About cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone

cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone (PubChem CID 110739832) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone
PubChem CID110739832
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Namecyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone
SMILESCC1OCCCN1C(=O)C1CCC1
InChIInChI=1S/C10H17NO2/c1-8-11(6-3-7-13-8)10(12)9-4-2-5-9/h8-9H,2-7H2,1H3
InChIKeyFDUAFHFQEIOJHD-UHFFFAOYSA-N
XLogP1.38
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methyl-1,3-oxazinan-3-yl)-(oxolan-2-yl)methanone
CID 110739759
1-(2-methyl-1,3-oxazinan-3-yl)butan-1-one
CID 110739753
cyclobutyl-(3-hydroxy-2-methylpiperidin-1-yl)methanone
CID 127015560
cyclobutyl-(2,3-dimethylpyrrolidin-1-yl)methanone
CID 130944377
cyclobutyl-(2,5-dimethylmorpholin-4-yl)methanone
CID 110727653
[(1S,3R)-3-[(3R)-3-methylmorpholine-4-carbonyl]cyclohexyl]-[(3R)-3-methylmorpholin-4-yl]methanone
CID 124866912
cyclobutyl-[2-(2-hydroxypropyl)pyrrolidin-1-yl]methanone
CID 79546457
cyclohexyl-[(2R)-2-[(2R)-2-methylmorpholine-4-carbonyl]pyrrolidin-1-yl]methanone
CID 94154419
cyclobutyl-[(2R)-2-[(2R)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 129428271
cyclobutyl-(2-cyclopropylpyrrolidin-1-yl)methanone
CID 110871814
[2-(chloromethyl)-3-methylpyrrolidin-1-yl]-cyclobutylmethanone
CID 102786836
cyclobutyl-(2,3-dimethylthiomorpholin-4-yl)methanone
CID 71930717

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone?
The IUPAC name of cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone (CID 110739832) is cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone.
What is the SMILES notation for cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone?
The canonical SMILES for cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone is CC1OCCCN1C(=O)C1CCC1.
What is the InChIKey of cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone?
The InChIKey is FDUAFHFQEIOJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-8-11(6-3-7-13-8)10(12)9-4-2-5-9/h8-9H,2-7H2,1H3.
What are the key properties of cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone?
cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone has a molecular weight of 183.25 g/mol, XLogP of 1.38, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(2-methyl-1,3-oxazinan-3-yl)methanone is sourced from PubChem (CID 110739832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).