N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide

C15H18N2O4 — CID 142970056

IUPACN-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NC(C)(C)C)c(=O)[nH]c2c1O
InChIInChI=1S/C15H18N2O4/c1-15(2,3)17-14(20)9-7-8-5-6-10(21-4)12(18)11(8)16-13(9)19/h5-7,18H,1-4H3,(H,16,19)(H,17,20)
InChIKeyUUTWCXBGOACONQ-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.77
Rot. Bonds2

About N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide

N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 142970056) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide
PubChem CID142970056
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC NameN-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NC(C)(C)C)c(=O)[nH]c2c1O
InChIInChI=1S/C15H18N2O4/c1-15(2,3)17-14(20)9-7-8-5-6-10(21-4)12(18)11(8)16-13(9)19/h5-7,18H,1-4H3,(H,16,19)(H,17,20)
InChIKeyUUTWCXBGOACONQ-UHFFFAOYSA-N
XLogP1.77
TPSA91.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-7-methoxy-2-oxo-8-phenylmethoxy-1H-quinoline-3-carboxamide
CID 142970025
N-tert-butyl-7-methoxy-2-oxo-8-[2-oxo-2-(propan-2-ylamino)ethoxy]-1H-quinoline-3-carboxamide
CID 142970240
N-tert-butyl-7-methoxy-2-oxo-8-phenacyloxy-1H-quinoline-3-carboxamide
CID 142970370
N-tert-butyl-7-methoxy-2-oxo-8-(1-phenylmethoxypentan-2-yloxy)-1H-quinoline-3-carboxamide;ethane
CID 142970066
N-tert-butyl-7-methoxy-2-oxo-8-(2-phenylmethoxypentoxy)-1H-quinoline-3-carboxamide
CID 142969996
8-bromo-7-methoxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 165352016
1-N,2-N,4-N,5-N-tetratert-butylbenzene-1,2,4,5-tetracarboxamide
CID 141420303
8-methoxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 22690286
N-tert-butyl-4-methoxy-2,5-dimethylbenzamide
CID 110761615
N-tert-butyl-2-methoxy-4-trimethylsilylbenzamide
CID 155681345
N-tert-butyl-2-methoxy-4-propan-2-ylbenzamide
CID 110762942
N-[2-(3,4-dihydroxyphenyl)ethyl]-7-methoxy-2-oxo-8-pentoxy-1H-quinoline-3-carboxamide
CID 11626344

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide (CID 142970056) is N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide is COc1ccc2cc(C(=O)NC(C)(C)C)c(=O)[nH]c2c1O.
What is the InChIKey of N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is UUTWCXBGOACONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-15(2,3)17-14(20)9-7-8-5-6-10(21-4)12(18)11(8)16-13(9)19/h5-7,18H,1-4H3,(H,16,19)(H,17,20).
What are the key properties of N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide?
N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 1.77, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-8-hydroxy-7-methoxy-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 142970056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).