(3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate

C24H19NO2 — CID 24881742

IUPAC(3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate
SMILESO=C(NCc1ccc2ccccc2c1)Oc1cccc(-c2ccccc2)c1
InChIInChI=1S/C24H19NO2/c26-24(25-17-18-13-14-20-9-4-5-10-21(20)15-18)27-23-12-6-11-22(16-23)19-7-2-1-3-8-19/h1-16H,17H2,(H,25,26)
InChIKeyVVPJFBDRRNTRBA-UHFFFAOYSA-N
MW353.42 g/mol
LogP5.80
Rot. Bonds4

About (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate

(3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate (PubChem CID 24881742) has the molecular formula C24H19NO2 and a molecular weight of 353.42 g/mol. Its IUPAC name is (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate.

Molecular Properties

Compound Name(3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate
PubChem CID24881742
Molecular FormulaC24H19NO2
Molecular Weight353.42 g/mol
Exact Mass353.14
IUPAC Name(3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate
SMILESO=C(NCc1ccc2ccccc2c1)Oc1cccc(-c2ccccc2)c1
InChIInChI=1S/C24H19NO2/c26-24(25-17-18-13-14-20-9-4-5-10-21(20)15-18)27-23-12-6-11-22(16-23)19-7-2-1-3-8-19/h1-16H,17H2,(H,25,26)
InChIKeyVVPJFBDRRNTRBA-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-2-ylmethyl)carbamate?
The IUPAC name of (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate (CID 24881742) is (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate.
What is the SMILES notation for (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate?
The canonical SMILES for (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate is O=C(NCc1ccc2ccccc2c1)Oc1cccc(-c2ccccc2)c1.
What is the InChIKey of (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate?
The InChIKey is VVPJFBDRRNTRBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO2/c26-24(25-17-18-13-14-20-9-4-5-10-21(20)15-18)27-23-12-6-11-22(16-23)19-7-2-1-3-8-19/h1-16H,17H2,(H,25,26).
What are the key properties of (3-phenylphenyl) N-(naphthalen-2-ylmethyl)carbamate?
(3-phenylphenyl) N-(naphthalen-2-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-2-ylmethyl)carbamate is sourced from PubChem (CID 24881742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).