N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide

C15H18FN3O2 — CID 102778058

IUPACN-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)Nc1cc2c(cc1F)CCC(=O)N2
InChIInChI=1S/C15H18FN3O2/c1-8-4-5-17-14(8)15(21)19-12-7-11-9(6-10(12)16)2-3-13(20)18-11/h6-8,14,17H,2-5H2,1H3,(H,18,20)(H,19,21)
InChIKeyONLYDQYQYINXIJ-UHFFFAOYSA-N
MW291.33 g/mol
LogP1.65
Rot. Bonds2

About N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide

N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide (PubChem CID 102778058) has the molecular formula C15H18FN3O2 and a molecular weight of 291.33 g/mol. Its IUPAC name is N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide
PubChem CID102778058
Molecular FormulaC15H18FN3O2
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC NameN-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide
SMILESCC1CCNC1C(=O)Nc1cc2c(cc1F)CCC(=O)N2
InChIInChI=1S/C15H18FN3O2/c1-8-4-5-17-14(8)15(21)19-12-7-11-9(6-10(12)16)2-3-13(20)18-11/h6-8,14,17H,2-5H2,1H3,(H,18,20)(H,19,21)
InChIKeyONLYDQYQYINXIJ-UHFFFAOYSA-N
XLogP1.65
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide?
The IUPAC name of N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide (CID 102778058) is N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide is CC1CCNC1C(=O)Nc1cc2c(cc1F)CCC(=O)N2.
What is the InChIKey of N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide?
The InChIKey is ONLYDQYQYINXIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O2/c1-8-4-5-17-14(8)15(21)19-12-7-11-9(6-10(12)16)2-3-13(20)18-11/h6-8,14,17H,2-5H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide?
N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide has a molecular weight of 291.33 g/mol, XLogP of 1.65, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-oxo-3,4-dihydro-1H-quinolin-7-yl)-3-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 102778058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).