N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide

C19H18FN3O — CID 134702606

IUPACN-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1ccccc1F)Cc1ccc2ncccc2c1
InChIInChI=1S/C19H18FN3O/c1-23(13-19(24)22-18-7-3-2-6-16(18)20)12-14-8-9-17-15(11-14)5-4-10-21-17/h2-11H,12-13H2,1H3,(H,22,24)
InChIKeyZTDDLAJUAKSPKZ-UHFFFAOYSA-N
MW323.37 g/mol
LogP3.44
Rot. Bonds5

About N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide

N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide (PubChem CID 134702606) has the molecular formula C19H18FN3O and a molecular weight of 323.37 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide
PubChem CID134702606
Molecular FormulaC19H18FN3O
Molecular Weight323.37 g/mol
Exact Mass323.14
IUPAC NameN-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1ccccc1F)Cc1ccc2ncccc2c1
InChIInChI=1S/C19H18FN3O/c1-23(13-19(24)22-18-7-3-2-6-16(18)20)12-14-8-9-17-15(11-14)5-4-10-21-17/h2-11H,12-13H2,1H3,(H,22,24)
InChIKeyZTDDLAJUAKSPKZ-UHFFFAOYSA-N
XLogP3.44
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9054040
N-(4-chloro-2-fluorophenyl)-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide
CID 17487361
2-[(1-ethylpyrazol-4-yl)methyl-methylamino]-N-(2-fluorophenyl)acetamide
CID 22194251
2-methyl-3-[methyl(quinolin-6-ylmethyl)amino]propanoic acid
CID 55007348
2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide
CID 8901088
3-[[2-(2-fluoroanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60987825
N,N'-bis(2-fluorophenyl)-2-(quinolin-6-ylmethylidene)propanediamide
CID 55353614
2-[(3,4-dimethoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide
CID 16555072
N-(2-fluorophenyl)-2-[methyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]acetamide
CID 135473828
2-[benzyl(methyl)amino]-N-(2-fluoro-4-methylphenyl)acetamide
CID 8901380
N-(2-aminophenyl)-2-[methyl(pyridin-3-ylmethyl)amino]acetamide
CID 43563126
N-(2,5-difluorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8778357

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide (CID 134702606) is N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide is CN(CC(=O)Nc1ccccc1F)Cc1ccc2ncccc2c1.
What is the InChIKey of N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide?
The InChIKey is ZTDDLAJUAKSPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O/c1-23(13-19(24)22-18-7-3-2-6-16(18)20)12-14-8-9-17-15(11-14)5-4-10-21-17/h2-11H,12-13H2,1H3,(H,22,24).
What are the key properties of N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide?
N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide has a molecular weight of 323.37 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide is sourced from PubChem (CID 134702606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).