N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide

C20H19N3O2 — CID 67960562

IUPACN-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide
SMILESNC1CCCc2ccc(NC(=O)c3cc4ccccc4[nH]c3=O)cc21
InChIInChI=1S/C20H19N3O2/c21-17-6-3-5-12-8-9-14(11-15(12)17)22-19(24)16-10-13-4-1-2-7-18(13)23-20(16)25/h1-2,4,7-11,17H,3,5-6,21H2,(H,22,24)(H,23,25)
InChIKeyNGGACSZBWQYSGI-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.12
Rot. Bonds2

About N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide

N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 67960562) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide
PubChem CID67960562
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC NameN-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide
SMILESNC1CCCc2ccc(NC(=O)c3cc4ccccc4[nH]c3=O)cc21
InChIInChI=1S/C20H19N3O2/c21-17-6-3-5-12-8-9-14(11-15(12)17)22-19(24)16-10-13-4-1-2-7-18(13)23-20(16)25/h1-2,4,7-11,17H,3,5-6,21H2,(H,22,24)(H,23,25)
InChIKeyNGGACSZBWQYSGI-UHFFFAOYSA-N
XLogP3.12
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 21393481
N-cyclohexyl-2-oxo-1H-quinoline-3-carboxamide
CID 11011060
2-oxo-N-[3-(5H-tetrazol-5-yl)phenyl]-1H-quinoline-3-carboxamide
CID 25068582
N-(2-amino-1-cyclopropylethyl)-2-oxo-1H-quinoline-3-carboxamide;hydrochloride
CID 119614890
N-[(1S)-1-amino-2,3-dihydro-1H-inden-5-yl]-6-methyl-2-oxo-5-phenyl-1H-pyridine-3-carboxamide
CID 166329777
N-methyl-2-oxo-1H-quinoline-3-carboxamide
CID 16613028
N-[4-(3-amino-3-oxopropoxy)phenyl]-2-oxo-1H-quinoline-3-carboxamide
CID 55728032
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-indole-2-carboxamide;hydrochloride
CID 141145124
N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-2-oxo-1H-quinoline-3-carboxamide
CID 55946831
N-[3-benzyl-4-(difluoromethoxy)phenyl]-2-oxo-1H-quinoline-3-carboxamide
CID 24624798
N-[(2S)-2-cyclohexyl-1-hydroxypropan-2-yl]-2-oxo-1H-quinoline-3-carboxamide
CID 99827233
N-(2-bromoethyl)-2-oxo-1H-quinoline-3-carboxamide
CID 142731854

Frequently Asked Questions

What is the IUPAC name of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide (CID 67960562) is N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide is NC1CCCc2ccc(NC(=O)c3cc4ccccc4[nH]c3=O)cc21.
What is the InChIKey of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is NGGACSZBWQYSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c21-17-6-3-5-12-8-9-14(11-15(12)17)22-19(24)16-10-13-4-1-2-7-18(13)23-20(16)25/h1-2,4,7-11,17H,3,5-6,21H2,(H,22,24)(H,23,25).
What are the key properties of N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide?
N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.12, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 67960562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).