N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide

C14H16N2O4 — CID 66168370

IUPACN-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide
SMILESCC(O)(CO)CNC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C14H16N2O4/c1-14(20,8-17)7-15-13(19)10-6-12(18)16-11-5-3-2-4-9(10)11/h2-6,17,20H,7-8H2,1H3,(H,15,19)(H,16,18)
InChIKeyJSNRDTMTWULZGZ-UHFFFAOYSA-N
MW276.29 g/mol
LogP0.00
Rot. Bonds4

About N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide

N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 66168370) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide
PubChem CID66168370
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide
SMILESCC(O)(CO)CNC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C14H16N2O4/c1-14(20,8-17)7-15-13(19)10-6-12(18)16-11-5-3-2-4-9(10)11/h2-6,17,20H,7-8H2,1H3,(H,15,19)(H,16,18)
InChIKeyJSNRDTMTWULZGZ-UHFFFAOYSA-N
XLogP0.00
TPSA102.42 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 50.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-2-morpholin-4-ylpropyl)-2-oxo-1H-quinoline-4-carboxamide
CID 2450820
N-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]-2-oxo-1H-quinoline-4-carboxamide
CID 29299185
N-[2-(methylamino)-2-oxoethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 2542774
2-oxo-1H-quinoline-4-carbohydrazide
CID 676699
N-[3-(dimethylamino)propyl]-2-oxo-1H-quinoline-4-carboxamide
CID 110694434
N-[(4-fluorophenyl)methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 3617215
N-(2,3-dihydroxy-2-methylpropyl)-1H-indazole-3-carboxamide
CID 66171472
2-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-quinoline-4-carboxamide
CID 18162773
N-[2-(3-hydroxypropylsulfanyl)ethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 103767277
methyl 4-[(2-oxo-1H-quinoline-4-carbonyl)amino]butanoate
CID 29131557
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 26447386
ethyl 4-[(2-oxo-1H-quinoline-4-carbonyl)amino]butanoate
CID 37262146

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide (CID 66168370) is N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide is CC(O)(CO)CNC(=O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is JSNRDTMTWULZGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-14(20,8-17)7-15-13(19)10-6-12(18)16-11-5-3-2-4-9(10)11/h2-6,17,20H,7-8H2,1H3,(H,15,19)(H,16,18).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide?
N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 276.29 g/mol, XLogP of 0.00, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 66168370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).