(2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene

C29H27NO2 — CID 70294493

IUPAC(2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene
SMILESN[C@@H](CO)Cc1ccccc1.c1ccc2cc(Oc3ccc4ccccc4c3)ccc2c1
InChIInChI=1S/C20H14O.C9H13NO/c1-3-7-17-13-19(11-9-15(17)5-1)21-20-12-10-16-6-2-4-8-18(16)14-20;10-9(7-11)6-8-4-2-1-3-5-8/h1-14H;1-5,9,11H,6-7,10H2/t;9-/m.1/s1
InChIKeyGQMVDBLWNDVQFI-YYVQYPFISA-N
MW421.54 g/mol
LogP6.33
Rot. Bonds5

About (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene

(2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene (PubChem CID 70294493) has the molecular formula C29H27NO2 and a molecular weight of 421.54 g/mol. Its IUPAC name is (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene.

Molecular Properties

Compound Name(2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene
PubChem CID70294493
Molecular FormulaC29H27NO2
Molecular Weight421.54 g/mol
Exact Mass421.20
IUPAC Name(2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene
SMILESN[C@@H](CO)Cc1ccccc1.c1ccc2cc(Oc3ccc4ccccc4c3)ccc2c1
InChIInChI=1S/C20H14O.C9H13NO/c1-3-7-17-13-19(11-9-15(17)5-1)21-20-12-10-16-6-2-4-8-18(16)14-20;10-9(7-11)6-8-4-2-1-3-5-8/h1-14H;1-5,9,11H,6-7,10H2/t;9-/m.1/s1
InChIKeyGQMVDBLWNDVQFI-YYVQYPFISA-N
XLogP6.33
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.54
LogP ≤ 56.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-phenylpropan-1-ol;methanamine
CID 162684961
(2S)-2-amino-3-[4-(4-methoxyphenoxy)phenyl]propan-1-ol;hydrochloride
CID 24815980
2-amino-3-[3-(3,5-dichlorophenoxy)phenyl]propan-1-ol
CID 170893180
2-amino-N-hydroxy-3-(4-naphthalen-2-yloxyphenyl)propanamide
CID 23148265
2-amino-3-(4-methoxyphenyl)propan-1-ol
CID 14412118
(2S)-2-amino-3-(4-methoxyphenyl)propan-1-ol
CID 11788635
ethane;ethanol;methane;2-methylpropane;2-naphthalen-2-yloxynaphthalene
CID 161131721
(2S)-2-amino-3-(4-methoxyphenyl)propan-1-ol;hydrochloride
CID 131875869
2-(3,5-dinaphthalen-2-yloxyphenoxy)naphthalene
CID 135017313
(2R)-2-naphthalen-2-yloxy-3-(4-phenoxyphenyl)propanoic acid
CID 100545011
(2S,3R)-3-amino-4-phenylbutane-1,2-diol
CID 11789833
(2S)-2-amino-3-(3-methoxyphenyl)propan-1-ol
CID 28804581

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene?
The IUPAC name of (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene (CID 70294493) is (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene.
What is the SMILES notation for (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene?
The canonical SMILES for (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene is N[C@@H](CO)Cc1ccccc1.c1ccc2cc(Oc3ccc4ccccc4c3)ccc2c1.
What is the InChIKey of (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene?
The InChIKey is GQMVDBLWNDVQFI-YYVQYPFISA-N. The full InChI is InChI=1S/C20H14O.C9H13NO/c1-3-7-17-13-19(11-9-15(17)5-1)21-20-12-10-16-6-2-4-8-18(16)14-20;10-9(7-11)6-8-4-2-1-3-5-8/h1-14H;1-5,9,11H,6-7,10H2/t;9-/m.1/s1.
What are the key properties of (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene?
(2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene has a molecular weight of 421.54 g/mol, XLogP of 6.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-phenylpropan-1-ol;2-naphthalen-2-yloxynaphthalene is sourced from PubChem (CID 70294493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).