(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine

C12H19NO — CID 118327627

IUPAC(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
SMILESCCN(C)[C@H](C)c1ccccc1OC
InChIInChI=1S/C12H19NO/c1-5-13(3)10(2)11-8-6-7-9-12(11)14-4/h6-10H,5H2,1-4H3/t10-/m1/s1
InChIKeyHSGCIYFJKZEQGV-SNVBAGLBSA-N
MW193.29 g/mol
LogP2.71
Rot. Bonds4

About (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine

(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine (PubChem CID 118327627) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine.

Molecular Properties

Compound Name(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
PubChem CID118327627
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine
SMILESCCN(C)[C@H](C)c1ccccc1OC
InChIInChI=1S/C12H19NO/c1-5-13(3)10(2)11-8-6-7-9-12(11)14-4/h6-10H,5H2,1-4H3/t10-/m1/s1
InChIKeyHSGCIYFJKZEQGV-SNVBAGLBSA-N
XLogP2.71
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
The IUPAC name of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine (CID 118327627) is (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine.
What is the SMILES notation for (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
The canonical SMILES for (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine is CCN(C)[C@H](C)c1ccccc1OC.
What is the InChIKey of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
The InChIKey is HSGCIYFJKZEQGV-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H19NO/c1-5-13(3)10(2)11-8-6-7-9-12(11)14-4/h6-10H,5H2,1-4H3/t10-/m1/s1.
What are the key properties of (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine?
(1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-ethyl-1-(2-methoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 118327627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).