(4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine

C15H23NO2 — CID 65155038

IUPAC(4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
SMILESCOc1ccc(C(N)C2C(C)OC(C)C2C)cc1
InChIInChI=1S/C15H23NO2/c1-9-10(2)18-11(3)14(9)15(16)12-5-7-13(17-4)8-6-12/h5-11,14-15H,16H2,1-4H3
InChIKeyWWELVBIRUBLERJ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.75
Rot. Bonds3

About (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine

(4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine (PubChem CID 65155038) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine.

Molecular Properties

Compound Name(4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
PubChem CID65155038
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
SMILESCOc1ccc(C(N)C2C(C)OC(C)C2C)cc1
InChIInChI=1S/C15H23NO2/c1-9-10(2)18-11(3)14(9)15(16)12-5-7-13(17-4)8-6-12/h5-11,14-15H,16H2,1-4H3
InChIKeyWWELVBIRUBLERJ-UHFFFAOYSA-N
XLogP2.75
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)propan-1-amine
CID 115864775
[3-(4-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)propyl]hydrazine
CID 105310622
(4-methoxyphenyl)-(2-methyloxolan-3-yl)methanamine
CID 79758244
(2-fluoro-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 65158185
1-(3,5-dimethoxyphenyl)-N-methyl-1-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 105013524
(2,4-dimethylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 65154996
(2-methylnaphthalen-1-yl)-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 81431016
(2,4-dichlorophenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 65156692
(3-bromo-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 65160656
1-(4-cyclopropyloxyphenyl)-N-methyl-1-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 105051346
3-(4-methoxyphenyl)butan-2-amine
CID 54524041
O-[4-[1,2-bis(4-aminooxyphenyl)-2-(4-methoxyphenyl)ethyl]phenyl]hydroxylamine
CID 161215163

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine?
The IUPAC name of (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine (CID 65155038) is (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine.
What is the SMILES notation for (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine?
The canonical SMILES for (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine is COc1ccc(C(N)C2C(C)OC(C)C2C)cc1.
What is the InChIKey of (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine?
The InChIKey is WWELVBIRUBLERJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-9-10(2)18-11(3)14(9)15(16)12-5-7-13(17-4)8-6-12/h5-11,14-15H,16H2,1-4H3.
What are the key properties of (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine?
(4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine has a molecular weight of 249.35 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanamine is sourced from PubChem (CID 65155038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).