N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide

C18H18FN3O3 — CID 166667339

IUPACN-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cc2c(cc1F)NC(=O)C(C)(C)C2
InChIInChI=1S/C18H18FN3O3/c1-18(2)8-10-6-14(12(19)7-13(10)22-17(18)24)21-16(23)11-4-5-20-9-15(11)25-3/h4-7,9H,8H2,1-3H3,(H,21,23)(H,22,24)
InChIKeySDTRJCZCRNNJKA-UHFFFAOYSA-N
MW343.36 g/mol
LogP3.00
Rot. Bonds3

About N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide

N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide (PubChem CID 166667339) has the molecular formula C18H18FN3O3 and a molecular weight of 343.36 g/mol. Its IUPAC name is N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide
PubChem CID166667339
Molecular FormulaC18H18FN3O3
Molecular Weight343.36 g/mol
Exact Mass343.13
IUPAC NameN-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cc2c(cc1F)NC(=O)C(C)(C)C2
InChIInChI=1S/C18H18FN3O3/c1-18(2)8-10-6-14(12(19)7-13(10)22-17(18)24)21-16(23)11-4-5-20-9-15(11)25-3/h4-7,9H,8H2,1-3H3,(H,21,23)(H,22,24)
InChIKeySDTRJCZCRNNJKA-UHFFFAOYSA-N
XLogP3.00
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.36
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-amino-2-fluorophenyl)-3-methoxypyridine-4-carboxamide
CID 105062950
N-(3-fluoro-4-hydroxyphenyl)-3-methoxypyridine-4-carboxamide
CID 105063689
3-[(3-methoxypyridine-4-carbonyl)amino]-5-methyl-1H-pyrrole-2-carboxylic acid
CID 105063309
N-(5-bromo-2-methoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 64949895
N-(2,5-dimethoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 115645348
3-methoxy-N-(1H-pyrazol-4-yl)pyridine-4-carboxamide
CID 105063971
N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide
CID 105063564
4-[(3-methoxypyridine-4-carbonyl)amino]-3-methylbenzoic acid
CID 105063077
N-(4-amino-3-bromophenyl)-3-methoxypyridine-4-carboxamide
CID 105063037
N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide
CID 105063446
N-(3-amino-4-pyridinyl)-4-bromo-2-methoxybenzamide
CID 115368565
N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide
CID 105062895

Frequently Asked Questions

What is the IUPAC name of N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide?
The IUPAC name of N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide (CID 166667339) is N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide?
The canonical SMILES for N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide is COc1cnccc1C(=O)Nc1cc2c(cc1F)NC(=O)C(C)(C)C2.
What is the InChIKey of N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide?
The InChIKey is SDTRJCZCRNNJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O3/c1-18(2)8-10-6-14(12(19)7-13(10)22-17(18)24)21-16(23)11-4-5-20-9-15(11)25-3/h4-7,9H,8H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide?
N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide has a molecular weight of 343.36 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-fluoro-3,3-dimethyl-2-oxo-1,4-dihydroquinolin-6-yl)-3-methoxypyridine-4-carboxamide is sourced from PubChem (CID 166667339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).