3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide

C18H16FN3O2 — CID 110674030

IUPAC3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide
SMILESCc1cc(NC(=O)CCc2cc3ccc(F)cc3[nH]c2=O)ccn1
InChIInChI=1S/C18H16FN3O2/c1-11-8-15(6-7-20-11)21-17(23)5-3-13-9-12-2-4-14(19)10-16(12)22-18(13)24/h2,4,6-10H,3,5H2,1H3,(H,22,24)(H,20,21,23)
InChIKeyQEFCQUWHUZNSDT-UHFFFAOYSA-N
MW325.34 g/mol
LogP2.94
Rot. Bonds4

About 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide

3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide (PubChem CID 110674030) has the molecular formula C18H16FN3O2 and a molecular weight of 325.34 g/mol. Its IUPAC name is 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide
PubChem CID110674030
Molecular FormulaC18H16FN3O2
Molecular Weight325.34 g/mol
Exact Mass325.12
IUPAC Name3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide
SMILESCc1cc(NC(=O)CCc2cc3ccc(F)cc3[nH]c2=O)ccn1
InChIInChI=1S/C18H16FN3O2/c1-11-8-15(6-7-20-11)21-17(23)5-3-13-9-12-2-4-14(19)10-16(12)22-18(13)24/h2,4,6-10H,3,5H2,1H3,(H,22,24)(H,20,21,23)
InChIKeyQEFCQUWHUZNSDT-UHFFFAOYSA-N
XLogP2.94
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110423904
N-(2,6-dimethylphenyl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110418371
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(4-methoxyphenyl)propanamide
CID 110422053
ethyl 4-[3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanoylamino]benzoate
CID 110426665
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110674032
N-(5-chloro-2-methylphenyl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110420828
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide
CID 110406226
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-propan-2-yloxyphenyl)propanamide
CID 110422559
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 110419247
N-butan-2-yl-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110406868
N-cyclopentyl-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110407034
N-(3-fluorophenyl)-3-(6-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331277

Frequently Asked Questions

What is the IUPAC name of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide?
The IUPAC name of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide (CID 110674030) is 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide.
What is the SMILES notation for 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide?
The canonical SMILES for 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide is Cc1cc(NC(=O)CCc2cc3ccc(F)cc3[nH]c2=O)ccn1.
What is the InChIKey of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide?
The InChIKey is QEFCQUWHUZNSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O2/c1-11-8-15(6-7-20-11)21-17(23)5-3-13-9-12-2-4-14(19)10-16(12)22-18(13)24/h2,4,6-10H,3,5H2,1H3,(H,22,24)(H,20,21,23).
What are the key properties of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide?
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide has a molecular weight of 325.34 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(2-methyl-4-pyridinyl)propanamide is sourced from PubChem (CID 110674030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).