(2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine

C12H19NO — CID 791949

IUPAC(2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine
SMILESCOC[C@@H](C)NCc1ccccc1C
InChIInChI=1S/C12H19NO/c1-10-6-4-5-7-12(10)8-13-11(2)9-14-3/h4-7,11,13H,8-9H2,1-3H3/t11-/m1/s1
InChIKeyIBQJRTAAPFIEHG-LLVKDONJSA-N
MW193.29 g/mol
LogP2.12
Rot. Bonds5

About (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine

(2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine (PubChem CID 791949) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine.

Molecular Properties

Compound Name(2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine
PubChem CID791949
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine
SMILESCOC[C@@H](C)NCc1ccccc1C
InChIInChI=1S/C12H19NO/c1-10-6-4-5-7-12(10)8-13-11(2)9-14-3/h4-7,11,13H,8-9H2,1-3H3/t11-/m1/s1
InChIKeyIBQJRTAAPFIEHG-LLVKDONJSA-N
XLogP2.12
TPSA21.26 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 ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-1-methoxy-N-[(2-methylphenyl)methyl]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

Related Compounds

N-[(2-methylphenyl)methyl]butan-2-amine chloride
CID 19629109
(2R)-2-N-[(2-methylphenyl)methyl]propane-1,2-diamine
CID 104867967
(2S)-N-[(2,3-dimethoxyphenyl)methyl]-1-methoxypropan-2-amine
CID 775451
1-methoxy-N-[(2-prop-2-enoxyphenyl)methyl]propan-2-amine
CID 43220851
4-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]butan-2-amine
CID 60913277
(2S)-1-methoxy-N-[(4-methoxynaphthalen-1-yl)methyl]propan-2-amine
CID 792105
1-methoxy-N-[2-(2-methylphenoxy)ethyl]propan-2-amine
CID 60688548
2-(methoxymethyl)-3-(2-methylphenyl)-N-propan-2-ylpropan-1-amine
CID 103984383
1-(1-methoxypropan-2-yl)-2-[(2-methylphenyl)methyl]guanidine
CID 111031466
N-[(4-fluoro-2-methylphenyl)methyl]-1-(2-methylphenyl)propan-2-amine
CID 62136472
3-chloro-4-methoxy-N-[(2-methylphenyl)methyl]butan-1-amine
CID 106242611
N-(1-methoxypropan-2-yl)-2,6-dimethylaniline
CID 10899497

Frequently Asked Questions

What is the IUPAC name of (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine?
The IUPAC name of (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine (CID 791949) is (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine.
What is the SMILES notation for (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine?
The canonical SMILES for (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine is COC[C@@H](C)NCc1ccccc1C.
What is the InChIKey of (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine?
The InChIKey is IBQJRTAAPFIEHG-LLVKDONJSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-6-4-5-7-12(10)8-13-11(2)9-14-3/h4-7,11,13H,8-9H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine?
(2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-methoxy-N-[(2-methylphenyl)methyl]propan-2-amine is sourced from PubChem (CID 791949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).