(2R)-1-(4-methoxyphenyl)propan-2-amine

C10H15NO — CID 6951129

IUPAC(2R)-1-(4-methoxyphenyl)propan-2-amine
SMILESCOc1ccc(C[C@@H](C)N)cc1
InChIInChI=1S/C10H15NO/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3/t8-/m1/s1
InChIKeyNEGYEDYHPHMHGK-MRVPVSSYSA-N
MW165.24 g/mol
LogP1.58
Rot. Bonds3

About (2R)-1-(4-methoxyphenyl)propan-2-amine

(2R)-1-(4-methoxyphenyl)propan-2-amine (PubChem CID 6951129) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (2R)-1-(4-methoxyphenyl)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(4-methoxyphenyl)propan-2-amine
PubChem CID6951129
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(2R)-1-(4-methoxyphenyl)propan-2-amine
SMILESCOc1ccc(C[C@@H](C)N)cc1
InChIInChI=1S/C10H15NO/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3/t8-/m1/s1
InChIKeyNEGYEDYHPHMHGK-MRVPVSSYSA-N
XLogP1.58
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(4-methoxyphenyl)propan-2-amine?
The IUPAC name of (2R)-1-(4-methoxyphenyl)propan-2-amine (CID 6951129) is (2R)-1-(4-methoxyphenyl)propan-2-amine.
What is the SMILES notation for (2R)-1-(4-methoxyphenyl)propan-2-amine?
The canonical SMILES for (2R)-1-(4-methoxyphenyl)propan-2-amine is COc1ccc(C[C@@H](C)N)cc1.
What is the InChIKey of (2R)-1-(4-methoxyphenyl)propan-2-amine?
The InChIKey is NEGYEDYHPHMHGK-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3/t8-/m1/s1.
What are the key properties of (2R)-1-(4-methoxyphenyl)propan-2-amine?
(2R)-1-(4-methoxyphenyl)propan-2-amine has a molecular weight of 165.24 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(4-methoxyphenyl)propan-2-amine is sourced from PubChem (CID 6951129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).