N-(3-oxocyclobutyl)quinoline-2-carboxamide

C14H12N2O2 — CID 141469344

IUPACN-(3-oxocyclobutyl)quinoline-2-carboxamide
SMILESO=C1CC(NC(=O)c2ccc3ccccc3n2)C1
InChIInChI=1S/C14H12N2O2/c17-11-7-10(8-11)15-14(18)13-6-5-9-3-1-2-4-12(9)16-13/h1-6,10H,7-8H2,(H,15,18)
InChIKeyYLTXJFLGNXHNEN-UHFFFAOYSA-N
MW240.26 g/mol
LogP1.70
Rot. Bonds2

About N-(3-oxocyclobutyl)quinoline-2-carboxamide

N-(3-oxocyclobutyl)quinoline-2-carboxamide (PubChem CID 141469344) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-(3-oxocyclobutyl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(3-oxocyclobutyl)quinoline-2-carboxamide
PubChem CID141469344
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC NameN-(3-oxocyclobutyl)quinoline-2-carboxamide
SMILESO=C1CC(NC(=O)c2ccc3ccccc3n2)C1
InChIInChI=1S/C14H12N2O2/c17-11-7-10(8-11)15-14(18)13-6-5-9-3-1-2-4-12(9)16-13/h1-6,10H,7-8H2,(H,15,18)
InChIKeyYLTXJFLGNXHNEN-UHFFFAOYSA-N
XLogP1.70
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-propan-2-ylazetidin-3-yl)quinoline-2-carboxamide
CID 100627820
N-(2-aminocyclopentyl)quinoline-2-carboxamide
CID 63251270
3-[4-(quinoline-2-carbonylamino)cyclohexylidene]propanoic acid
CID 174670110
2-(quinoline-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 64814765
N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide
CID 96506885
N-[3-(quinoline-2-carbonylamino)propyl]quinoline-2-carboxamide
CID 11603405
N-[(7S)-3-oxo-2,5,6,7,8,9-hexahydro-[1,2,4]triazolo[4,3-a]azepin-7-yl]quinoline-2-carboxamide
CID 99738597
N-[6-(quinoline-2-carbonylamino)hexyl]quinoline-2-carboxamide
CID 139197064
N'-(cyclopropanecarbonyl)quinoline-2-carbohydrazide
CID 26798961
N-(4-methylpyrazolidin-3-yl)quinoline-2-carboxamide
CID 134068357
N-[(3-aminocyclobutyl)methyl]quinoline-2-carboxamide
CID 66005598
N-(1,2,3,4-tetrahydronaphthalen-1-yl)quinoline-2-carboxamide
CID 5135545

Frequently Asked Questions

What is the IUPAC name of N-(3-oxocyclobutyl)quinoline-2-carboxamide?
The IUPAC name of N-(3-oxocyclobutyl)quinoline-2-carboxamide (CID 141469344) is N-(3-oxocyclobutyl)quinoline-2-carboxamide.
What is the SMILES notation for N-(3-oxocyclobutyl)quinoline-2-carboxamide?
The canonical SMILES for N-(3-oxocyclobutyl)quinoline-2-carboxamide is O=C1CC(NC(=O)c2ccc3ccccc3n2)C1.
What is the InChIKey of N-(3-oxocyclobutyl)quinoline-2-carboxamide?
The InChIKey is YLTXJFLGNXHNEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c17-11-7-10(8-11)15-14(18)13-6-5-9-3-1-2-4-12(9)16-13/h1-6,10H,7-8H2,(H,15,18).
What are the key properties of N-(3-oxocyclobutyl)quinoline-2-carboxamide?
N-(3-oxocyclobutyl)quinoline-2-carboxamide has a molecular weight of 240.26 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-oxocyclobutyl)quinoline-2-carboxamide is sourced from PubChem (CID 141469344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).