(2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine

C18H23NO2 — CID 69022765

IUPAC(2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine
SMILESCN[C@H](C)Cc1ccc(-c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C18H23NO2/c1-13(19-2)9-14-5-7-15(8-6-14)16-10-17(20-3)12-18(11-16)21-4/h5-8,10-13,19H,9H2,1-4H3/t13-/m1/s1
InChIKeyFILLAMWIPSDBKF-CYBMUJFWSA-N
MW285.39 g/mol
LogP3.52
Rot. Bonds6

About (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine

(2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine (PubChem CID 69022765) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine.

Molecular Properties

Compound Name(2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine
PubChem CID69022765
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name(2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine
SMILESCN[C@H](C)Cc1ccc(-c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C18H23NO2/c1-13(19-2)9-14-5-7-15(8-6-14)16-10-17(20-3)12-18(11-16)21-4/h5-8,10-13,19H,9H2,1-4H3/t13-/m1/s1
InChIKeyFILLAMWIPSDBKF-CYBMUJFWSA-N
XLogP3.52
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(4-phenylphenyl)propan-2-amine
CID 82540674
1-[4-(3,5-dimethoxyphenyl)phenyl]-3,5-dimethoxybenzene
CID 139197183
N-methyl-1-(4-pyridin-4-ylphenyl)propan-2-amine
CID 82540626
N-[1-[4-(4-methoxyphenyl)phenyl]propan-2-yl]-2-methylpropan-1-amine
CID 82262403
1-[4-(5-fluoro-2-methoxyphenyl)phenyl]-N-methylpropan-2-amine
CID 82540192
N-methyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]propan-2-amine
CID 82540074
1-[4-[4-[2-(dimethylamino)ethoxy]phenyl]phenyl]-N-methylpropan-2-amine
CID 110447832
N-[1-[4-(4-methoxyphenyl)phenyl]propan-2-yl]cyclopropanamine
CID 82262623
2-methoxy-5-[2-(methylamino)propyl]aniline
CID 82257468
1-(4-methoxy-3-methylphenyl)-N-methylpropan-2-amine;hydrobromide
CID 21150467
1-(4-fluoro-3-methoxyphenyl)-N-methylpropan-2-amine
CID 69036284
1-[4-[3-[(dimethylamino)methyl]phenyl]phenyl]-N-methylpropan-2-amine
CID 82540027

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine?
The IUPAC name of (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine (CID 69022765) is (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine.
What is the SMILES notation for (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine?
The canonical SMILES for (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine is CN[C@H](C)Cc1ccc(-c2cc(OC)cc(OC)c2)cc1.
What is the InChIKey of (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine?
The InChIKey is FILLAMWIPSDBKF-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H23NO2/c1-13(19-2)9-14-5-7-15(8-6-14)16-10-17(20-3)12-18(11-16)21-4/h5-8,10-13,19H,9H2,1-4H3/t13-/m1/s1.
What are the key properties of (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine?
(2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine has a molecular weight of 285.39 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[4-(3,5-dimethoxyphenyl)phenyl]-N-methylpropan-2-amine is sourced from PubChem (CID 69022765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).