N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine

C24H27NO — CID 15722769

IUPACN-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine
SMILESCC(C)N[C@H](c1ccccc1)[C@@H](OCc1ccccc1)c1ccccc1
InChIInChI=1S/C24H27NO/c1-19(2)25-23(21-14-8-4-9-15-21)24(22-16-10-5-11-17-22)26-18-20-12-6-3-7-13-20/h3-17,19,23-25H,18H2,1-2H3/t23-,24+/m1/s1
InChIKeyFAAXEAOLDRMTGA-RPWUZVMVSA-N
MW345.49 g/mol
LogP5.68
Rot. Bonds8

About N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine

N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine (PubChem CID 15722769) has the molecular formula C24H27NO and a molecular weight of 345.49 g/mol. Its IUPAC name is N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine.

Molecular Properties

Compound NameN-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine
PubChem CID15722769
Molecular FormulaC24H27NO
Molecular Weight345.49 g/mol
Exact Mass345.21
IUPAC NameN-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine
SMILESCC(C)N[C@H](c1ccccc1)[C@@H](OCc1ccccc1)c1ccccc1
InChIInChI=1S/C24H27NO/c1-19(2)25-23(21-14-8-4-9-15-21)24(22-16-10-5-11-17-22)26-18-20-12-6-3-7-13-20/h3-17,19,23-25H,18H2,1-2H3/t23-,24+/m1/s1
InChIKeyFAAXEAOLDRMTGA-RPWUZVMVSA-N
XLogP5.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.49
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,2S)-N,N'-bis[(2S)-3-methyl-1-phenylmethoxybutan-2-yl]-1,2-diphenylethane-1,2-diamine
CID 177391195
1-chloroethoxymethylbenzene
CID 12510706
1-[(1R,2R)-2-methyl-1-phenylmethoxybut-3-enyl]-4-phenylbenzene
CID 164669353
benzhydryloxymethylbenzene
CID 11437288
(S)-2-methyl-N-[(1S,2S)-1-phenyl-2-phenylmethoxypropyl]propane-2-sulfinamide
CID 11348534
(R)-2-methyl-N-[(1S,2S)-1-phenyl-2-phenylmethoxypropyl]propane-2-sulfinamide
CID 11348533
N,N-dimethyl-4-[(1R,2R)-2-methyl-1-phenylmethoxybut-3-enyl]aniline
CID 164669352
1-methyl-4-(1-phenylmethoxyethyl)benzene
CID 135034119
1-ethoxy-1-phenyl-N-(1-phenylpropan-2-yl)propan-2-amine
CID 110176857
2-phenylmethoxy-N-propan-2-ylbutan-1-amine
CID 62446151
[(2R)-3-methylbutan-2-yl]oxymethylbenzene
CID 59976472
ditert-butyl 2-[(1R,2S)-1-hydroxy-2-phenyl-2-phenylmethoxyethyl]propanedioate
CID 10972261

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine?
The IUPAC name of N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine (CID 15722769) is N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine.
What is the SMILES notation for N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine?
The canonical SMILES for N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine is CC(C)N[C@H](c1ccccc1)[C@@H](OCc1ccccc1)c1ccccc1.
What is the InChIKey of N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine?
The InChIKey is FAAXEAOLDRMTGA-RPWUZVMVSA-N. The full InChI is InChI=1S/C24H27NO/c1-19(2)25-23(21-14-8-4-9-15-21)24(22-16-10-5-11-17-22)26-18-20-12-6-3-7-13-20/h3-17,19,23-25H,18H2,1-2H3/t23-,24+/m1/s1.
What are the key properties of N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine?
N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine has a molecular weight of 345.49 g/mol, XLogP of 5.68, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2S)-1,2-diphenyl-2-phenylmethoxyethyl]propan-2-amine is sourced from PubChem (CID 15722769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).