7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one

C18H17FN2O2 — CID 56714046

IUPAC7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(F)ccc2cc1CN1CCCC1c1ccco1
InChIInChI=1S/C18H17FN2O2/c19-14-6-5-12-9-13(18(22)20-15(12)10-14)11-21-7-1-3-16(21)17-4-2-8-23-17/h2,4-6,8-10,16H,1,3,7,11H2,(H,20,22)
InChIKeyVVQBQWFPCILXCA-UHFFFAOYSA-N
MW312.34 g/mol
LogP3.60
Rot. Bonds3

About 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one

7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one (PubChem CID 56714046) has the molecular formula C18H17FN2O2 and a molecular weight of 312.34 g/mol. Its IUPAC name is 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
PubChem CID56714046
Molecular FormulaC18H17FN2O2
Molecular Weight312.34 g/mol
Exact Mass312.13
IUPAC Name7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(F)ccc2cc1CN1CCCC1c1ccco1
InChIInChI=1S/C18H17FN2O2/c19-14-6-5-12-9-13(18(22)20-15(12)10-14)11-21-7-1-3-16(21)17-4-2-8-23-17/h2,4-6,8-10,16H,1,3,7,11H2,(H,20,22)
InChIKeyVVQBQWFPCILXCA-UHFFFAOYSA-N
XLogP3.60
TPSA49.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-fluoro-3-[[(3R)-4-(furan-2-ylmethyl)-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-1H-quinolin-2-one
CID 98710583
3-[[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 95780229
3-[[2-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 128967624
3-[[(2S)-2-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 129473497
2-[(2S)-2-(furan-2-yl)pyrrolidin-1-yl]acetic acid
CID 42575452
(3R,7aR)-2-(4-fluorophenyl)-3-(furan-2-yl)-5,6,7,7a-tetrahydro-3H-pyrrolo[1,2-c]imidazol-1-one
CID 11878355
5-[1-[(2-oxo-1H-quinolin-3-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazole-3-carboxamide
CID 128999927
7-methoxy-3-[[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 95216039
3-[3-[3-(furan-2-yl)pyrrolidin-1-yl]-3-oxopropyl]-1H-quinolin-2-one
CID 110424560
6,7-dimethoxy-3-[[(2R)-2-(4-methyl-1,2,5-oxadiazol-3-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 95230978
6,7-dimethoxy-3-[[(2S)-2-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 95207084
3-[[2-(methoxymethyl)piperidin-1-yl]methyl]-7-methyl-1H-quinolin-2-one
CID 56721682

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one?
The IUPAC name of 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one (CID 56714046) is 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one.
What is the SMILES notation for 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one?
The canonical SMILES for 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one is O=c1[nH]c2cc(F)ccc2cc1CN1CCCC1c1ccco1.
What is the InChIKey of 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one?
The InChIKey is VVQBQWFPCILXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2/c19-14-6-5-12-9-13(18(22)20-15(12)10-14)11-21-7-1-3-16(21)17-4-2-8-23-17/h2,4-6,8-10,16H,1,3,7,11H2,(H,20,22).
What are the key properties of 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one?
7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one has a molecular weight of 312.34 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-[[2-(furan-2-yl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one is sourced from PubChem (CID 56714046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).