(2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine

C12H19NO — CID 96656753

IUPAC(2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine
SMILESCc1ccc(COC[C@@H](C)N)c(C)c1
InChIInChI=1S/C12H19NO/c1-9-4-5-12(10(2)6-9)8-14-7-11(3)13/h4-6,11H,7-8,13H2,1-3H3/t11-/m1/s1
InChIKeyAIHWUPQGSOTAMO-LLVKDONJSA-N
MW193.29 g/mol
LogP2.17
Rot. Bonds4

About (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine

(2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine (PubChem CID 96656753) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine
PubChem CID96656753
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine
SMILESCc1ccc(COC[C@@H](C)N)c(C)c1
InChIInChI=1S/C12H19NO/c1-9-4-5-12(10(2)6-9)8-14-7-11(3)13/h4-6,11H,7-8,13H2,1-3H3/t11-/m1/s1
InChIKeyAIHWUPQGSOTAMO-LLVKDONJSA-N
XLogP2.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-[(2,4-dimethylphenyl)methoxy]butan-2-amine
CID 97057919
1-(2,4-dimethylphenyl)propan-2-amine
CID 541870
(2R)-4-(2,4-dimethylphenyl)butan-2-amine
CID 95375920
1-[(2,4-dichlorophenyl)methoxy]propan-2-amine
CID 82475739
(2R)-1-[(3,4-dimethylphenyl)methoxy]propan-2-amine
CID 97057920
1-[4-[(2,4-dimethylphenyl)methoxy]-3-methylphenyl]ethanamine
CID 82092954
4-chloro-2-methyl-1-(2-methylpropoxymethyl)benzene
CID 91716374
1-N-[2-(2,4-dimethylphenyl)ethyl]-1-N-methylpropane-1,2-diamine
CID 115196905
1-(2,4-dimethylphenyl)-2-[(2-fluorophenyl)methoxy]ethanamine
CID 63932433
(2,4-dimethylphenyl)methyl 2,4,4-trimethylpentanoate
CID 102345880
2-[(2-amino-4-methylphenyl)methoxymethyl]-5-methylaniline
CID 141256981
4-[(2,4-dimethylphenyl)methoxy]aniline
CID 12822803

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine?
The IUPAC name of (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine (CID 96656753) is (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine.
What is the SMILES notation for (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine?
The canonical SMILES for (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine is Cc1ccc(COC[C@@H](C)N)c(C)c1.
What is the InChIKey of (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine?
The InChIKey is AIHWUPQGSOTAMO-LLVKDONJSA-N. The full InChI is InChI=1S/C12H19NO/c1-9-4-5-12(10(2)6-9)8-14-7-11(3)13/h4-6,11H,7-8,13H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine?
(2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2,4-dimethylphenyl)methoxy]propan-2-amine is sourced from PubChem (CID 96656753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).