N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine

C23H21N — CID 70877215

IUPACN-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine
SMILESCN(c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCC=C2
InChIInChI=1S/C23H21N/c1-24(23-16-13-19-9-5-6-10-21(19)17-23)22-14-11-20(12-15-22)18-7-3-2-4-8-18/h2-5,7-9,11-17H,6,10H2,1H3
InChIKeyHIQXHHZZVNOCJT-UHFFFAOYSA-N
MW311.43 g/mol
LogP6.08
Rot. Bonds3

About N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine

N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine (PubChem CID 70877215) has the molecular formula C23H21N and a molecular weight of 311.43 g/mol. Its IUPAC name is N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine.

Molecular Properties

Compound NameN-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine
PubChem CID70877215
Molecular FormulaC23H21N
Molecular Weight311.43 g/mol
Exact Mass311.17
IUPAC NameN-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine
SMILESCN(c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCC=C2
InChIInChI=1S/C23H21N/c1-24(23-16-13-19-9-5-6-10-21(19)17-23)22-14-11-20(12-15-22)18-7-3-2-4-8-18/h2-5,7-9,11-17H,6,10H2,1H3
InChIKeyHIQXHHZZVNOCJT-UHFFFAOYSA-N
XLogP6.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.43
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine?
The IUPAC name of N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine (CID 70877215) is N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine.
What is the SMILES notation for N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine?
The canonical SMILES for N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine is CN(c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCC=C2.
What is the InChIKey of N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine?
The InChIKey is HIQXHHZZVNOCJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N/c1-24(23-16-13-19-9-5-6-10-21(19)17-23)22-14-11-20(12-15-22)18-7-3-2-4-8-18/h2-5,7-9,11-17H,6,10H2,1H3.
What are the key properties of N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine?
N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine has a molecular weight of 311.43 g/mol, XLogP of 6.08, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine is sourced from PubChem (CID 70877215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).