N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide

C25H23N3O2 — CID 44536460

IUPACN-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide
SMILESCOc1ccc2nccc(NC(=O)CNCc3ccc(-c4ccccc4)cc3)c2c1
InChIInChI=1S/C25H23N3O2/c1-30-21-11-12-23-22(15-21)24(13-14-27-23)28-25(29)17-26-16-18-7-9-20(10-8-18)19-5-3-2-4-6-19/h2-15,26H,16-17H2,1H3,(H,27,28,29)
InChIKeyLKCDAHBOUBXXMS-UHFFFAOYSA-N
MW397.48 g/mol
LogP4.64
Rot. Bonds7

About N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide

N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide (PubChem CID 44536460) has the molecular formula C25H23N3O2 and a molecular weight of 397.48 g/mol. Its IUPAC name is N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide
PubChem CID44536460
Molecular FormulaC25H23N3O2
Molecular Weight397.48 g/mol
Exact Mass397.18
IUPAC NameN-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide
SMILESCOc1ccc2nccc(NC(=O)CNCc3ccc(-c4ccccc4)cc3)c2c1
InChIInChI=1S/C25H23N3O2/c1-30-21-11-12-23-22(15-21)24(13-14-27-23)28-25(29)17-26-16-18-7-9-20(10-8-18)19-5-3-2-4-6-19/h2-15,26H,16-17H2,1H3,(H,27,28,29)
InChIKeyLKCDAHBOUBXXMS-UHFFFAOYSA-N
XLogP4.64
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.48
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide?
The IUPAC name of N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide (CID 44536460) is N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide.
What is the SMILES notation for N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide?
The canonical SMILES for N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide is COc1ccc2nccc(NC(=O)CNCc3ccc(-c4ccccc4)cc3)c2c1.
What is the InChIKey of N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide?
The InChIKey is LKCDAHBOUBXXMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O2/c1-30-21-11-12-23-22(15-21)24(13-14-27-23)28-25(29)17-26-16-18-7-9-20(10-8-18)19-5-3-2-4-6-19/h2-15,26H,16-17H2,1H3,(H,27,28,29).
What are the key properties of N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide?
N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide has a molecular weight of 397.48 g/mol, XLogP of 4.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxyquinolin-4-yl)-2-[(4-phenylphenyl)methylamino]acetamide is sourced from PubChem (CID 44536460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).