(5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione

C23H20N2O4 — CID 89154929

IUPAC(5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione
SMILESNc1ccc(Oc2ccc3c(c2)CCC[C@H]3[C@H]2OC(=O)NC2=O)c2ccccc12
InChIInChI=1S/C23H20N2O4/c24-19-10-11-20(17-6-2-1-5-16(17)19)28-14-8-9-15-13(12-14)4-3-7-18(15)21-22(26)25-23(27)29-21/h1-2,5-6,8-12,18,21H,3-4,7,24H2,(H,25,26,27)/t18-,21-/m1/s1
InChIKeyNWTPVMBWAHHHGU-WIYYLYMNSA-N
MW388.42 g/mol
LogP4.27
Rot. Bonds3

About (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione

(5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione (PubChem CID 89154929) has the molecular formula C23H20N2O4 and a molecular weight of 388.42 g/mol. Its IUPAC name is (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione
PubChem CID89154929
Molecular FormulaC23H20N2O4
Molecular Weight388.42 g/mol
Exact Mass388.14
IUPAC Name(5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione
SMILESNc1ccc(Oc2ccc3c(c2)CCC[C@H]3[C@H]2OC(=O)NC2=O)c2ccccc12
InChIInChI=1S/C23H20N2O4/c24-19-10-11-20(17-6-2-1-5-16(17)19)28-14-8-9-15-13(12-14)4-3-7-18(15)21-22(26)25-23(27)29-21/h1-2,5-6,8-12,18,21H,3-4,7,24H2,(H,25,26,27)/t18-,21-/m1/s1
InChIKeyNWTPVMBWAHHHGU-WIYYLYMNSA-N
XLogP4.27
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione?
The IUPAC name of (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione (CID 89154929) is (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione?
The canonical SMILES for (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione is Nc1ccc(Oc2ccc3c(c2)CCC[C@H]3[C@H]2OC(=O)NC2=O)c2ccccc12.
What is the InChIKey of (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione?
The InChIKey is NWTPVMBWAHHHGU-WIYYLYMNSA-N. The full InChI is InChI=1S/C23H20N2O4/c24-19-10-11-20(17-6-2-1-5-16(17)19)28-14-8-9-15-13(12-14)4-3-7-18(15)21-22(26)25-23(27)29-21/h1-2,5-6,8-12,18,21H,3-4,7,24H2,(H,25,26,27)/t18-,21-/m1/s1.
What are the key properties of (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione?
(5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione has a molecular weight of 388.42 g/mol, XLogP of 4.27, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(1R)-6-(4-aminonaphthalen-1-yl)oxy-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 89154929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).