N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide

C18H16FN3O4S — CID 46275018

IUPACN-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)Nc1ccccc1F
InChIInChI=1S/C18H16FN3O4S/c19-14-3-1-2-4-16(14)22-18(24)9-10-20-27(25,26)13-6-7-15-12(11-13)5-8-17(23)21-15/h1-8,11,20H,9-10H2,(H,21,23)(H,22,24)
InChIKeyMLUGNTFFORLZRR-UHFFFAOYSA-N
MW389.41 g/mol
LogP1.97
Rot. Bonds6

About N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide

N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide (PubChem CID 46275018) has the molecular formula C18H16FN3O4S and a molecular weight of 389.41 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
PubChem CID46275018
Molecular FormulaC18H16FN3O4S
Molecular Weight389.41 g/mol
Exact Mass389.08
IUPAC NameN-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
SMILESO=C(CCNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)Nc1ccccc1F
InChIInChI=1S/C18H16FN3O4S/c19-14-3-1-2-4-16(14)22-18(24)9-10-20-27(25,26)13-6-7-15-12(11-13)5-8-17(23)21-15/h1-8,11,20H,9-10H2,(H,21,23)(H,22,24)
InChIKeyMLUGNTFFORLZRR-UHFFFAOYSA-N
XLogP1.97
TPSA108.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.41
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
CID 126459076
N-cyclohexyl-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
CID 46275014
3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 24639635
N-(2-methylcyclohexyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide
CID 46275051
N-(2-fluorophenyl)-3-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 26584303
N-(2-chlorophenyl)-3-[(4-fluorophenyl)sulfonylamino]propanamide
CID 17192162
3-(naphthalen-2-ylsulfonylamino)-N-phenylpropanamide
CID 9340894
N-(2-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]acetamide
CID 772291
2-oxo-N-(3-propan-2-yloxypropyl)-1H-quinoline-6-sulfonamide
CID 22548573
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-oxo-1H-quinoline-6-sulfonamide
CID 46361480
3-[(3,4-difluorophenyl)sulfonylamino]-N-(1H-indazol-5-yl)propanamide
CID 134037444
2-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-1H-quinoline-6-sulfonamide
CID 22576547

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
The IUPAC name of N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide (CID 46275018) is N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide.
What is the SMILES notation for N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
The canonical SMILES for N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide is O=C(CCNS(=O)(=O)c1ccc2[nH]c(=O)ccc2c1)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
The InChIKey is MLUGNTFFORLZRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O4S/c19-14-3-1-2-4-16(14)22-18(24)9-10-20-27(25,26)13-6-7-15-12(11-13)5-8-17(23)21-15/h1-8,11,20H,9-10H2,(H,21,23)(H,22,24).
What are the key properties of N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide?
N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide has a molecular weight of 389.41 g/mol, XLogP of 1.97, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]propanamide is sourced from PubChem (CID 46275018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).