N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide

C15H14N4O3 — CID 162466167

IUPACN-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide
SMILESNC1CC(NC(=O)c2cccc3cccnc23)C(=O)NC1=O
InChIInChI=1S/C15H14N4O3/c16-10-7-11(15(22)19-14(10)21)18-13(20)9-5-1-3-8-4-2-6-17-12(8)9/h1-6,10-11H,7,16H2,(H,18,20)(H,19,21,22)
InChIKeyJDCRKHNOMYTULW-UHFFFAOYSA-N
MW298.30 g/mol
LogP-0.29
Rot. Bonds2

About N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide

N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide (PubChem CID 162466167) has the molecular formula C15H14N4O3 and a molecular weight of 298.30 g/mol. Its IUPAC name is N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide
PubChem CID162466167
Molecular FormulaC15H14N4O3
Molecular Weight298.30 g/mol
Exact Mass298.11
IUPAC NameN-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide
SMILESNC1CC(NC(=O)c2cccc3cccnc23)C(=O)NC1=O
InChIInChI=1S/C15H14N4O3/c16-10-7-11(15(22)19-14(10)21)18-13(20)9-5-1-3-8-4-2-6-17-12(8)9/h1-6,10-11H,7,16H2,(H,18,20)(H,19,21,22)
InChIKeyJDCRKHNOMYTULW-UHFFFAOYSA-N
XLogP-0.29
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminocyclopropyl)quinoline-8-carboxamide
CID 62875389
N-pyrimidin-2-ylquinoline-8-carboxamide
CID 175780986
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]quinoline-8-carboxamide
CID 69380368
N'-[(1S,2R)-2-methylcyclopropanecarbonyl]quinoline-8-carbohydrazide
CID 97315545
4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid
CID 66221838
N-[[1-(aminomethyl)cyclopropyl]methyl]quinoline-8-carboxamide
CID 115456767
2-(dimethylamino)-N-(2,6-dioxopiperidin-3-yl)pyridine-3-carboxamide
CID 110475174
N-(2-amino-1-cyclopropylethyl)quinoline-8-carboxamide;dihydrochloride
CID 119615422
N-[4-(cyclopropylcarbamoyl)phenyl]quinoline-8-carboxamide
CID 51300002
N-[2-(cyclopropylamino)ethyl]quinoline-8-carboxamide
CID 55126983
N-[[(2R,3S)-3-methylpiperidin-2-yl]methyl]quinoline-8-carboxamide
CID 131737120
palladium;quinoline-8-carboxylic acid
CID 174945118

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide?
The IUPAC name of N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide (CID 162466167) is N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide.
What is the SMILES notation for N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide?
The canonical SMILES for N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide is NC1CC(NC(=O)c2cccc3cccnc23)C(=O)NC1=O.
What is the InChIKey of N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide?
The InChIKey is JDCRKHNOMYTULW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3/c16-10-7-11(15(22)19-14(10)21)18-13(20)9-5-1-3-8-4-2-6-17-12(8)9/h1-6,10-11H,7,16H2,(H,18,20)(H,19,21,22).
What are the key properties of N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide?
N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide has a molecular weight of 298.30 g/mol, XLogP of -0.29, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,6-dioxopiperidin-3-yl)quinoline-8-carboxamide is sourced from PubChem (CID 162466167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).