(2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine

C12H19NO — CID 57465920

IUPAC(2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine
SMILESCOCCc1ccc(C[C@@H](C)N)cc1
InChIInChI=1S/C12H19NO/c1-10(13)9-12-5-3-11(4-6-12)7-8-14-2/h3-6,10H,7-9,13H2,1-2H3/t10-/m1/s1
InChIKeyQTJRPXKMVKLTBY-SNVBAGLBSA-N
MW193.29 g/mol
LogP1.77
Rot. Bonds5

About (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine

(2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine (PubChem CID 57465920) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine
PubChem CID57465920
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine
SMILESCOCCc1ccc(C[C@@H](C)N)cc1
InChIInChI=1S/C12H19NO/c1-10(13)9-12-5-3-11(4-6-12)7-8-14-2/h3-6,10H,7-9,13H2,1-2H3/t10-/m1/s1
InChIKeyQTJRPXKMVKLTBY-SNVBAGLBSA-N
XLogP1.77
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine?
The IUPAC name of (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine (CID 57465920) is (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine.
What is the SMILES notation for (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine?
The canonical SMILES for (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine is COCCc1ccc(C[C@@H](C)N)cc1.
What is the InChIKey of (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine?
The InChIKey is QTJRPXKMVKLTBY-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H19NO/c1-10(13)9-12-5-3-11(4-6-12)7-8-14-2/h3-6,10H,7-9,13H2,1-2H3/t10-/m1/s1.
What are the key properties of (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine?
(2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[4-(2-methoxyethyl)phenyl]propan-2-amine is sourced from PubChem (CID 57465920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).