N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide

C19H18N2O2 — CID 67199183

IUPACN-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1-c1nc2c(C)cccc2cc1CO
InChIInChI=1S/C19H18N2O2/c1-12-6-5-7-14-10-15(11-22)19(21-18(12)14)16-8-3-4-9-17(16)20-13(2)23/h3-10,22H,11H2,1-2H3,(H,20,23)
InChIKeyIJPAANXQYMEFPG-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.66
Rot. Bonds3

About N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide

N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide (PubChem CID 67199183) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide
PubChem CID67199183
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1-c1nc2c(C)cccc2cc1CO
InChIInChI=1S/C19H18N2O2/c1-12-6-5-7-14-10-15(11-22)19(21-18(12)14)16-8-3-4-9-17(16)20-13(2)23/h3-10,22H,11H2,1-2H3,(H,20,23)
InChIKeyIJPAANXQYMEFPG-UHFFFAOYSA-N
XLogP3.66
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-formyl-8-methylquinolin-2-yl)phenyl]acetamide
CID 87307305
3-(chloromethyl)-8-methyl-2-(2-methylphenyl)quinoline;[8-methyl-2-(2-methylphenyl)quinolin-3-yl]methanol
CID 158472926
N-[2-(hydroxymethyl)-3-methylphenyl]acetamide
CID 14368464
2-(8-methyl-2-phenylquinolin-3-yl)ethanol
CID 68623431
N-[2-(hydroxymethyl)phenyl]acetamide;hydrochloride
CID 142950008
ethane;N-[2-(hydroxymethyl)phenyl]acetamide
CID 91162619
N-(3-acetamidoazulen-1-yl)acetamide
CID 86151929
N-(6-acetamidohexyl)-1-(2-methylphenyl)isoquinoline-3-carboxamide
CID 59383470
[7-ethyl-8-methyl-2-[2-(trifluoromethyl)phenyl]quinolin-3-yl]methanol
CID 145483233
N-[2-(3-methyl-1,2,4-thiadiazol-5-yl)phenyl]acetamide
CID 19962111
N-[2-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-1-yl)phenyl]acetamide
CID 86096240
N-[2-(2-acetamido-6-methylphenyl)-3-methylphenyl]acetamide
CID 22971546

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide?
The IUPAC name of N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide (CID 67199183) is N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide?
The canonical SMILES for N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide is CC(=O)Nc1ccccc1-c1nc2c(C)cccc2cc1CO.
What is the InChIKey of N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide?
The InChIKey is IJPAANXQYMEFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-6-5-7-14-10-15(11-22)19(21-18(12)14)16-8-3-4-9-17(16)20-13(2)23/h3-10,22H,11H2,1-2H3,(H,20,23).
What are the key properties of N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide?
N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide has a molecular weight of 306.37 g/mol, XLogP of 3.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(hydroxymethyl)-8-methylquinolin-2-yl]phenyl]acetamide is sourced from PubChem (CID 67199183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).