(1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine

C26H25N — CID 72708685

IUPAC(1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine
SMILESC[C@H](c1cccc2ccccc12)N(C)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H25N/c1-20(25-14-8-12-24-11-6-7-13-26(24)25)27(2)19-21-15-17-23(18-16-21)22-9-4-3-5-10-22/h3-18,20H,19H2,1-2H3/t20-/m1/s1
InChIKeyNGKGDAJLTDWAHS-HXUWFJFHSA-N
MW351.49 g/mol
LogP6.70
Rot. Bonds5

About (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine

(1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine (PubChem CID 72708685) has the molecular formula C26H25N and a molecular weight of 351.49 g/mol. Its IUPAC name is (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine
PubChem CID72708685
Molecular FormulaC26H25N
Molecular Weight351.49 g/mol
Exact Mass351.20
IUPAC Name(1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine
SMILESC[C@H](c1cccc2ccccc12)N(C)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C26H25N/c1-20(25-14-8-12-24-11-6-7-13-26(24)25)27(2)19-21-15-17-23(18-16-21)22-9-4-3-5-10-22/h3-18,20H,19H2,1-2H3/t20-/m1/s1
InChIKeyNGKGDAJLTDWAHS-HXUWFJFHSA-N
XLogP6.70
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.49
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine?
The IUPAC name of (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine (CID 72708685) is (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine.
What is the SMILES notation for (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine?
The canonical SMILES for (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine is C[C@H](c1cccc2ccccc12)N(C)Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine?
The InChIKey is NGKGDAJLTDWAHS-HXUWFJFHSA-N. The full InChI is InChI=1S/C26H25N/c1-20(25-14-8-12-24-11-6-7-13-26(24)25)27(2)19-21-15-17-23(18-16-21)22-9-4-3-5-10-22/h3-18,20H,19H2,1-2H3/t20-/m1/s1.
What are the key properties of (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine?
(1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine has a molecular weight of 351.49 g/mol, XLogP of 6.70, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-methyl-1-naphthalen-1-yl-N-[(4-phenylphenyl)methyl]ethanamine is sourced from PubChem (CID 72708685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).