2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine

C13H19NO2 — CID 117228325

IUPAC2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine
SMILESCOc1ccccc1CC1(C)NC(C)CO1
InChIInChI=1S/C13H19NO2/c1-10-9-16-13(2,14-10)8-11-6-4-5-7-12(11)15-3/h4-7,10,14H,8-9H2,1-3H3
InChIKeyYBCCUMFJDRMSAW-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.96
Rot. Bonds3

About 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine

2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine (PubChem CID 117228325) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine
PubChem CID117228325
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine
SMILESCOc1ccccc1CC1(C)NC(C)CO1
InChIInChI=1S/C13H19NO2/c1-10-9-16-13(2,14-10)8-11-6-4-5-7-12(11)15-3/h4-7,10,14H,8-9H2,1-3H3
InChIKeyYBCCUMFJDRMSAW-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methoxyphenyl)methyl]-2,4,4-trimethyl-1,3-oxazolidine
CID 117228329
2-[(2-methoxyphenyl)methyl]-2,5,5-trimethyl-1,3-oxazinane
CID 117226883
2-[2-[(2-methoxyphenyl)methyl]-2-methyl-1,3-dioxolan-4-yl]acetic acid
CID 117169594
2-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
CID 66466669
[3-[(2-methoxyphenyl)methyl]-2-methyloxolan-3-yl]methanamine
CID 114533952
3-[(2-methoxyphenyl)methyl]-2,2,5,5-tetramethyloxolan-3-ol
CID 79928571
5-[(2-methoxyphenyl)methyl]-5-methyl-1,3-oxazolidine-2,4-dione
CID 114239606
1-[(2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol
CID 65050430
4-[(2-methoxyphenyl)methyl]-2-methylpyrrolidine
CID 23009519
1-[(2-methoxyphenyl)methyl]-3,5-dimethylpiperazine
CID 63863865
1-(cyclopent-3-en-1-ylmethyl)-2-methoxybenzene
CID 23391764
1-[(2-methoxyphenyl)methyl]-2,2-dimethylcyclohexan-1-ol
CID 79852943

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine?
The IUPAC name of 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine (CID 117228325) is 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine is COc1ccccc1CC1(C)NC(C)CO1.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine?
The InChIKey is YBCCUMFJDRMSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-10-9-16-13(2,14-10)8-11-6-4-5-7-12(11)15-3/h4-7,10,14H,8-9H2,1-3H3.
What are the key properties of 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine?
2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine has a molecular weight of 221.30 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine is sourced from PubChem (CID 117228325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).