(3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate

C24H19NO2 — CID 24881741

IUPAC(3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate
SMILESO=C(NCc1cccc2ccccc12)Oc1cccc(-c2ccccc2)c1
InChIInChI=1S/C24H19NO2/c26-24(25-17-21-13-6-11-19-10-4-5-15-23(19)21)27-22-14-7-12-20(16-22)18-8-2-1-3-9-18/h1-16H,17H2,(H,25,26)
InChIKeyCKQZVWJYKPSNAI-UHFFFAOYSA-N
MW353.42 g/mol
LogP5.80
Rot. Bonds4

About (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate

(3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate (PubChem CID 24881741) has the molecular formula C24H19NO2 and a molecular weight of 353.42 g/mol. Its IUPAC name is (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate.

Molecular Properties

Compound Name(3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate
PubChem CID24881741
Molecular FormulaC24H19NO2
Molecular Weight353.42 g/mol
Exact Mass353.14
IUPAC Name(3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate
SMILESO=C(NCc1cccc2ccccc12)Oc1cccc(-c2ccccc2)c1
InChIInChI=1S/C24H19NO2/c26-24(25-17-21-13-6-11-19-10-4-5-15-23(19)21)27-22-14-7-12-20(16-22)18-8-2-1-3-9-18/h1-16H,17H2,(H,25,26)
InChIKeyCKQZVWJYKPSNAI-UHFFFAOYSA-N
XLogP5.80
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.42
LogP ≤ 55.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate?
The IUPAC name of (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate (CID 24881741) is (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate.
What is the SMILES notation for (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate?
The canonical SMILES for (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate is O=C(NCc1cccc2ccccc12)Oc1cccc(-c2ccccc2)c1.
What is the InChIKey of (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate?
The InChIKey is CKQZVWJYKPSNAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO2/c26-24(25-17-21-13-6-11-19-10-4-5-15-23(19)21)27-22-14-7-12-20(16-22)18-8-2-1-3-9-18/h1-16H,17H2,(H,25,26).
What are the key properties of (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate?
(3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate has a molecular weight of 353.42 g/mol, XLogP of 5.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenylphenyl) N-(naphthalen-1-ylmethyl)carbamate is sourced from PubChem (CID 24881741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).