1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine

C15H23NO — CID 115850284

IUPAC1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
SMILESCNC(c1cccc(C)c1C)C1CCC(C)O1
InChIInChI=1S/C15H23NO/c1-10-6-5-7-13(12(10)3)15(16-4)14-9-8-11(2)17-14/h5-7,11,14-16H,8-9H2,1-4H3
InChIKeyHPOFMSYNHYUJSH-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.13
Rot. Bonds3

About 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine

1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine (PubChem CID 115850284) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
PubChem CID115850284
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
SMILESCNC(c1cccc(C)c1C)C1CCC(C)O1
InChIInChI=1S/C15H23NO/c1-10-6-5-7-13(12(10)3)15(16-4)14-9-8-11(2)17-14/h5-7,11,14-16H,8-9H2,1-4H3
InChIKeyHPOFMSYNHYUJSH-UHFFFAOYSA-N
XLogP3.13
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1,2-dihydroacenaphthylen-5-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 114939266
1-[2-(2-methoxyethoxy)phenyl]-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 105035228
(5-methyloxolan-2-yl)-(2-methylphenyl)methanol
CID 82838357
1-(2,3-dimethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 115850452
N-methyl-1-(5-methyloxolan-2-yl)-1-naphthalen-2-ylmethanamine
CID 115850967
1-(4-bromo-2,5-difluorophenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 81331183
1-(5-chloro-4-methylthiophen-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 102763790
1-(2,3-dimethylphenyl)-1-(3-ethylcyclopentyl)-N-methylmethanamine
CID 65412191
N-methyl-1-(5-methyloxolan-2-yl)-1-(3-phenyltriazol-4-yl)methanamine
CID 105043162
1-(2,3-dimethylphenyl)-1-(1,1-dioxothian-2-yl)-N-methylmethanamine
CID 115850460
[(2,3-difluoro-4-methylphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 107516568
N-methyl-1-(5-methyloxolan-2-yl)-1-(5-methylthiophen-3-yl)methanamine
CID 104991165

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
The IUPAC name of 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine (CID 115850284) is 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
The canonical SMILES for 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine is CNC(c1cccc(C)c1C)C1CCC(C)O1.
What is the InChIKey of 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
The InChIKey is HPOFMSYNHYUJSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-10-6-5-7-13(12(10)3)15(16-4)14-9-8-11(2)17-14/h5-7,11,14-16H,8-9H2,1-4H3.
What are the key properties of 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine has a molecular weight of 233.35 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine is sourced from PubChem (CID 115850284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).