4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine

C12H18N2O — CID 174590772

IUPAC4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine
SMILESCc1cccc(C2COC(C)(N)N2)c1C
InChIInChI=1S/C12H18N2O/c1-8-5-4-6-10(9(8)2)11-7-15-12(3,13)14-11/h4-6,11,14H,7,13H2,1-3H3
InChIKeyPKOIWJKJNJEDCR-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.60
Rot. Bonds1

About 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine

4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine (PubChem CID 174590772) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine.

Molecular Properties

Compound Name4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine
PubChem CID174590772
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine
SMILESCc1cccc(C2COC(C)(N)N2)c1C
InChIInChI=1S/C12H18N2O/c1-8-5-4-6-10(9(8)2)11-7-15-12(3,13)14-11/h4-6,11,14H,7,13H2,1-3H3
InChIKeyPKOIWJKJNJEDCR-UHFFFAOYSA-N
XLogP1.60
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(2,3-dimethylphenyl)azetidine
CID 130714481
(4R)-4-(2,3-dimethylphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184393
5-(2,3-dimethylphenyl)imidazolidine-2,4-dione
CID 62871197
3-(2,3-dimethylphenyl)-N,2,2-trimethylcyclobutan-1-amine
CID 81417183
(2,3-dimethylphenyl)cyclodecane
CID 21161883
2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
CID 117000312
1-[2-(chloromethyl)cyclopropyl]-2,3-dimethylbenzene
CID 81357781
4,5,9-trimethyl-9H-fluorene
CID 20673052
[2-(2,3-dimethylphenyl)piperidin-4-yl]methanol
CID 117000430
(8'R,10'R)-8',10'-difluoro-3',15'-dimethylspiro[dioxirane-3,9'-tricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,11,13-hexaene]
CID 101463871
(1R,2S,5S)-2-(2,3-dimethylphenyl)-6-oxa-3-azabicyclo[3.1.1]heptane
CID 176961297
4,4-dimethyl-2-(2-methylphenyl)-1,3-oxazolidine;hydrochloride
CID 117228480

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine?
The IUPAC name of 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine (CID 174590772) is 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine.
What is the SMILES notation for 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine?
The canonical SMILES for 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine is Cc1cccc(C2COC(C)(N)N2)c1C.
What is the InChIKey of 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine?
The InChIKey is PKOIWJKJNJEDCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-8-5-4-6-10(9(8)2)11-7-15-12(3,13)14-11/h4-6,11,14H,7,13H2,1-3H3.
What are the key properties of 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine?
4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine has a molecular weight of 206.29 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylphenyl)-2-methyl-1,3-oxazolidin-2-amine is sourced from PubChem (CID 174590772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).