6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide

C19H18FN3O3 — CID 74242682

IUPAC6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide
SMILESCOCC(c1ccccn1)N(C)C(=O)c1c[nH]c2ccc(F)cc2c1=O
InChIInChI=1S/C19H18FN3O3/c1-23(17(11-26-2)16-5-3-4-8-21-16)19(25)14-10-22-15-7-6-12(20)9-13(15)18(14)24/h3-10,17H,11H2,1-2H3,(H,22,24)
InChIKeyBZMQEHBDCWWOEA-UHFFFAOYSA-N
MW355.37 g/mol
LogP2.52
Rot. Bonds5

About 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide

6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide (PubChem CID 74242682) has the molecular formula C19H18FN3O3 and a molecular weight of 355.37 g/mol. Its IUPAC name is 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide
PubChem CID74242682
Molecular FormulaC19H18FN3O3
Molecular Weight355.37 g/mol
Exact Mass355.13
IUPAC Name6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide
SMILESCOCC(c1ccccn1)N(C)C(=O)c1c[nH]c2ccc(F)cc2c1=O
InChIInChI=1S/C19H18FN3O3/c1-23(17(11-26-2)16-5-3-4-8-21-16)19(25)14-10-22-15-7-6-12(20)9-13(15)18(14)24/h3-10,17H,11H2,1-2H3,(H,22,24)
InChIKeyBZMQEHBDCWWOEA-UHFFFAOYSA-N
XLogP2.52
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide
CID 97132449
N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 70760488
4-[3-(hydroxymethyl)phenyl]-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methylnaphthalene-1-carboxamide
CID 172662620
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N-methyl-2-phenylpyrimidine-5-carboxamide
CID 95123486
4-oxo-6-phenoxy-N-(1-pyridin-2-ylethyl)-1H-quinoline-3-carboxamide
CID 154840617
N-(2-methoxy-1-pyridin-2-ylethyl)-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 74239636
N-[(1S)-2-methoxy-1-pyridin-2-ylethyl]-N,4-dimethyl-2-propan-2-yl-1,3-thiazole-5-carboxamide
CID 97146350
3-(5,6-dimethyl-2-pyridinyl)-N-[(1S)-2-methoxy-1-pyridin-2-ylethyl]-N-methylbenzamide
CID 125439779
methyl 3-[(6-fluoro-4-oxo-1H-quinoline-3-carbonyl)amino]propanoate
CID 71706440
4-chloro-N-(2-methoxy-1-pyridin-2-ylethyl)-N,1-dimethylpyrazole-3-carboxamide
CID 131933604
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N-methyl-1-benzothiophene-5-carboxamide
CID 97152757
6-fluoro-N-(2-hydroxyethyl)-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-quinoline-3-carboxamide
CID 74237743

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide (CID 74242682) is 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide is COCC(c1ccccn1)N(C)C(=O)c1c[nH]c2ccc(F)cc2c1=O.
What is the InChIKey of 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide?
The InChIKey is BZMQEHBDCWWOEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3/c1-23(17(11-26-2)16-5-3-4-8-21-16)19(25)14-10-22-15-7-6-12(20)9-13(15)18(14)24/h3-10,17H,11H2,1-2H3,(H,22,24).
What are the key properties of 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide?
6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide has a molecular weight of 355.37 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 74242682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).