N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide

C26H25N3O — CID 10715726

IUPACN-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide
SMILESCc1cc(N)c2cc(NC(=O)c3ccccc3CCCc3ccccc3)ccc2n1
InChIInChI=1S/C26H25N3O/c1-18-16-24(27)23-17-21(14-15-25(23)28-18)29-26(30)22-13-6-5-11-20(22)12-7-10-19-8-3-2-4-9-19/h2-6,8-9,11,13-17H,7,10,12H2,1H3,(H2,27,28)(H,29,30)
InChIKeyGDSFRBOVQXWMPR-UHFFFAOYSA-N
MW395.51 g/mol
LogP5.55
Rot. Bonds6

About N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide

N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide (PubChem CID 10715726) has the molecular formula C26H25N3O and a molecular weight of 395.51 g/mol. Its IUPAC name is N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide.

Molecular Properties

Compound NameN-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide
PubChem CID10715726
Molecular FormulaC26H25N3O
Molecular Weight395.51 g/mol
Exact Mass395.20
IUPAC NameN-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide
SMILESCc1cc(N)c2cc(NC(=O)c3ccccc3CCCc3ccccc3)ccc2n1
InChIInChI=1S/C26H25N3O/c1-18-16-24(27)23-17-21(14-15-25(23)28-18)29-26(30)22-13-6-5-11-20(22)12-7-10-19-8-3-2-4-9-19/h2-6,8-9,11,13-17H,7,10,12H2,1H3,(H2,27,28)(H,29,30)
InChIKeyGDSFRBOVQXWMPR-UHFFFAOYSA-N
XLogP5.55
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.51
LogP ≤ 55.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide?
The IUPAC name of N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide (CID 10715726) is N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide.
What is the SMILES notation for N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide?
The canonical SMILES for N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide is Cc1cc(N)c2cc(NC(=O)c3ccccc3CCCc3ccccc3)ccc2n1.
What is the InChIKey of N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide?
The InChIKey is GDSFRBOVQXWMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O/c1-18-16-24(27)23-17-21(14-15-25(23)28-18)29-26(30)22-13-6-5-11-20(22)12-7-10-19-8-3-2-4-9-19/h2-6,8-9,11,13-17H,7,10,12H2,1H3,(H2,27,28)(H,29,30).
What are the key properties of N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide?
N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide has a molecular weight of 395.51 g/mol, XLogP of 5.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methylquinolin-6-yl)-2-(3-phenylpropyl)benzamide is sourced from PubChem (CID 10715726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).