methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate

C19H18N2O2 — CID 146289922

IUPACmethylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate
SMILESCNOC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1
InChIInChI=1S/C19H18N2O2/c1-13-16(12-18(22)23-20-2)19(14-8-4-3-5-9-14)15-10-6-7-11-17(15)21-13/h3-11,20H,12H2,1-2H3
InChIKeyUWZXFIYRNIBVTM-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.43
Rot. Bonds4

About methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate

methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate (PubChem CID 146289922) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate.

Molecular Properties

Compound Namemethylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate
PubChem CID146289922
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Namemethylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate
SMILESCNOC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1
InChIInChI=1S/C19H18N2O2/c1-13-16(12-18(22)23-20-2)19(14-8-4-3-5-9-14)15-10-6-7-11-17(15)21-13/h3-11,20H,12H2,1-2H3
InChIKeyUWZXFIYRNIBVTM-UHFFFAOYSA-N
XLogP3.43
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-methyl-4-phenylquinolin-3-yl)-N-propan-2-ylacetamide
CID 112759088
N-(3-hydroxypropyl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 110878183
N-(1-hydroxypropan-2-yl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 110887326
N-[(2-methoxyphenyl)methyl]-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 25496428
[1-(4-methoxyphenyl)-1-oxopropan-2-yl] 2-(2-methyl-4-phenylquinolin-3-yl)acetate
CID 18229343
1-(4-acetylpiperazin-1-yl)-2-(2-methyl-4-phenylquinolin-3-yl)ethanone
CID 112762995
N-(2-ethoxyphenyl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 112790890
methyl 3-methyl-2-[[2-(2-methyl-4-phenylquinolin-3-yl)acetyl]amino]pentanoate
CID 112791596
methyl 2-methyl-2-[[2-(2-methyl-4-phenylquinolin-3-yl)acetyl]amino]pentanoate
CID 112822200
3-(2-methyl-4-phenylquinolin-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
CID 58589599
[1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl] 2-(2-methyl-4-phenylquinolin-3-yl)acetate
CID 18273294
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-(2-methyl-4-phenylquinolin-3-yl)acetamide
CID 112794841

Frequently Asked Questions

What is the IUPAC name of methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate?
The IUPAC name of methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate (CID 146289922) is methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate.
What is the SMILES notation for methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate?
The canonical SMILES for methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate is CNOC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1.
What is the InChIKey of methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate?
The InChIKey is UWZXFIYRNIBVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-13-16(12-18(22)23-20-2)19(14-8-4-3-5-9-14)15-10-6-7-11-17(15)21-13/h3-11,20H,12H2,1-2H3.
What are the key properties of methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate?
methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate has a molecular weight of 306.37 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methylamino 2-(2-methyl-4-phenylquinolin-3-yl)acetate is sourced from PubChem (CID 146289922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).