3-fluoro-2H-quinoline-3-carboxamide

C10H9FN2O — CID 163446550

IUPAC3-fluoro-2H-quinoline-3-carboxamide
SMILESNC(=O)C1(F)C=c2ccccc2=NC1
InChIInChI=1S/C10H9FN2O/c11-10(9(12)14)5-7-3-1-2-4-8(7)13-6-10/h1-5H,6H2,(H2,12,14)
InChIKeyBDABBQXSOXNFEG-UHFFFAOYSA-N
MW192.19 g/mol
LogP-0.71
Rot. Bonds1

About 3-fluoro-2H-quinoline-3-carboxamide

3-fluoro-2H-quinoline-3-carboxamide (PubChem CID 163446550) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 3-fluoro-2H-quinoline-3-carboxamide.

Molecular Properties

Compound Name3-fluoro-2H-quinoline-3-carboxamide
PubChem CID163446550
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name3-fluoro-2H-quinoline-3-carboxamide
SMILESNC(=O)C1(F)C=c2ccccc2=NC1
InChIInChI=1S/C10H9FN2O/c11-10(9(12)14)5-7-3-1-2-4-8(7)13-6-10/h1-5H,6H2,(H2,12,14)
InChIKeyBDABBQXSOXNFEG-UHFFFAOYSA-N
XLogP-0.71
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-3H-quinolin-2-one
CID 119086068
2,3-difluoro-2H-quinoline-3-carboxamide
CID 141386751
3-(Aminomethyl)-5-fluoroindol-2-one
CID 71463741
3-(aminomethyl)-7-fluoro-3H-quinolin-2-one
CID 74251623
5-fluoro-2H-indole-3-carboxamide
CID 124517537
3-(azidomethyl)-7-fluoro-3H-quinolin-2-one
CID 178188863
2H-indole-3-carboxamide
CID 124518031
3-(Aminomethyl)-1,4-benzodiazepin-2-one
CID 152199547
6-Methyl-2,3-dihydro-1,5-benzodiazepin-4-one
CID 174760058
3-methylsulfanyl-2H-quinoline-3-carboxamide
CID 176188214
3-(Aminomethyl)-5-fluoroindolin-2-onehydrochloride
CID 71463740
3-(aminomethyl)-3H-quinoxalin-2-one
CID 76851164

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2H-quinoline-3-carboxamide?
The IUPAC name of 3-fluoro-2H-quinoline-3-carboxamide (CID 163446550) is 3-fluoro-2H-quinoline-3-carboxamide.
What is the SMILES notation for 3-fluoro-2H-quinoline-3-carboxamide?
The canonical SMILES for 3-fluoro-2H-quinoline-3-carboxamide is NC(=O)C1(F)C=c2ccccc2=NC1.
What is the InChIKey of 3-fluoro-2H-quinoline-3-carboxamide?
The InChIKey is BDABBQXSOXNFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c11-10(9(12)14)5-7-3-1-2-4-8(7)13-6-10/h1-5H,6H2,(H2,12,14).
What are the key properties of 3-fluoro-2H-quinoline-3-carboxamide?
3-fluoro-2H-quinoline-3-carboxamide has a molecular weight of 192.19 g/mol, XLogP of -0.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2H-quinoline-3-carboxamide is sourced from PubChem (CID 163446550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).