(4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one

C19H23NO2 — CID 69336559

IUPAC(4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one
SMILESCNC[C@H](CCC(=O)c1ccccc1OC)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-20-14-16(15-8-4-3-5-9-15)12-13-18(21)17-10-6-7-11-19(17)22-2/h3-11,16,20H,12-14H2,1-2H3/t16-/m0/s1
InChIKeySIIMZGIDVWNLKZ-INIZCTEOSA-N
MW297.40 g/mol
LogP3.66
Rot. Bonds8

About (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one

(4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one (PubChem CID 69336559) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one.

Molecular Properties

Compound Name(4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one
PubChem CID69336559
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name(4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one
SMILESCNC[C@H](CCC(=O)c1ccccc1OC)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-20-14-16(15-8-4-3-5-9-15)12-13-18(21)17-10-6-7-11-19(17)22-2/h3-11,16,20H,12-14H2,1-2H3/t16-/m0/s1
InChIKeySIIMZGIDVWNLKZ-INIZCTEOSA-N
XLogP3.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-hydroxy-1,5-bis(2-methoxyphenyl)pentane-1,5-dione
CID 11738943
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
3-amino-1-(2-methoxyphenyl)-3-phenylpropan-1-one
CID 116553157
5-methoxy-N-methyl-2-phenylpentan-1-amine
CID 65430583
2-[4-[2-(2-methoxyphenyl)-2-oxoethyl]phenyl]acetic acid
CID 158147821
3-(2-methoxyphenyl)-3-oxopropane-1-sulfonic acid
CID 94688299
1-(2-methoxyphenyl)undecan-1-one
CID 63411736
2-fluoro-1-(2-methoxyphenyl)ethanone
CID 11816076
1-(2-methoxyphenyl)-3-phenylbut-3-en-1-one
CID 67489510
3-[(2-methoxybenzoyl)amino]propanoic acid
CID 67981005
6-(2-methoxyphenyl)-2,4,6-trioxohexanoic acid
CID 20842227
(2R)-2-hydroxy-1-(2-methoxyphenyl)hexane-1,5-dione
CID 101179657

Frequently Asked Questions

What is the IUPAC name of (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one?
The IUPAC name of (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one (CID 69336559) is (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one.
What is the SMILES notation for (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one?
The canonical SMILES for (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one is CNC[C@H](CCC(=O)c1ccccc1OC)c1ccccc1.
What is the InChIKey of (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one?
The InChIKey is SIIMZGIDVWNLKZ-INIZCTEOSA-N. The full InChI is InChI=1S/C19H23NO2/c1-20-14-16(15-8-4-3-5-9-15)12-13-18(21)17-10-6-7-11-19(17)22-2/h3-11,16,20H,12-14H2,1-2H3/t16-/m0/s1.
What are the key properties of (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one?
(4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one has a molecular weight of 297.40 g/mol, XLogP of 3.66, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-(2-methoxyphenyl)-5-(methylamino)-4-phenylpentan-1-one is sourced from PubChem (CID 69336559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).