(2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone

C14H19NO2 — CID 110740136

IUPAC(2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone
SMILESCC(C)c1ccc(C(=O)N2CCOC2C)cc1
InChIInChI=1S/C14H19NO2/c1-10(2)12-4-6-13(7-5-12)14(16)15-8-9-17-11(15)3/h4-7,10-11H,8-9H2,1-3H3
InChIKeyYPYZGYAKHWOXJW-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.63
Rot. Bonds2

About (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone

(2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone (PubChem CID 110740136) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone.

Molecular Properties

Compound Name(2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone
PubChem CID110740136
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name(2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone
SMILESCC(C)c1ccc(C(=O)N2CCOC2C)cc1
InChIInChI=1S/C14H19NO2/c1-10(2)12-4-6-13(7-5-12)14(16)15-8-9-17-11(15)3/h4-7,10-11H,8-9H2,1-3H3
InChIKeyYPYZGYAKHWOXJW-UHFFFAOYSA-N
XLogP2.63
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2,3-dimethylmorpholin-4-yl)-(4-propan-2-ylphenyl)methanone
CID 110727739
(3,4-dimethylphenyl)-(2-methyl-1,3-oxazolidin-3-yl)methanone
CID 110740144
(3-methylazetidin-1-yl)-(4-propan-2-ylphenyl)methanone
CID 176864535
(3,5-dimethylpiperidin-1-yl)-(4-propan-2-ylphenyl)methanone
CID 4191222
[2-(bromomethyl)morpholin-4-yl]-(4-propan-2-ylphenyl)methanone
CID 81212043
(2-phenylmorpholin-4-yl)-(4-propan-2-ylphenyl)methanone
CID 84510718
[3,5-bis(trifluoromethyl)phenyl]-[(2S)-2-methyl-1,3-oxazolidin-3-yl]methanone
CID 175972159
[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-(4-propan-2-ylphenyl)methanone
CID 8948835
(2,3-dimethylmorpholin-4-yl)-(4-fluorophenyl)methanone
CID 110727735
[2-(hydroxymethyl)azepan-1-yl]-(4-propan-2-ylphenyl)methanone
CID 116636276
(4-aminopiperidin-1-yl)-(4-propan-2-ylphenyl)methanone
CID 18071748
[2-[4-(dimethylamino)phenyl]morpholin-4-yl]-(4-propan-2-ylphenyl)methanone
CID 110364195

Frequently Asked Questions

What is the IUPAC name of (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone?
The IUPAC name of (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone (CID 110740136) is (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone.
What is the SMILES notation for (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone?
The canonical SMILES for (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone is CC(C)c1ccc(C(=O)N2CCOC2C)cc1.
What is the InChIKey of (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone?
The InChIKey is YPYZGYAKHWOXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-10(2)12-4-6-13(7-5-12)14(16)15-8-9-17-11(15)3/h4-7,10-11H,8-9H2,1-3H3.
What are the key properties of (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone?
(2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone has a molecular weight of 233.31 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-1,3-oxazolidin-3-yl)-(4-propan-2-ylphenyl)methanone is sourced from PubChem (CID 110740136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).