6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one

C23H24N2O3 — CID 11538083

IUPAC6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one
SMILESCc1ccc(CC2CCN(C(=O)c3cc(=O)c4cc(O)ccc4[nH]3)CC2)cc1
InChIInChI=1S/C23H24N2O3/c1-15-2-4-16(5-3-15)12-17-8-10-25(11-9-17)23(28)21-14-22(27)19-13-18(26)6-7-20(19)24-21/h2-7,13-14,17,26H,8-12H2,1H3,(H,24,27)
InChIKeyNRKFXELBKOAUIH-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.64
Rot. Bonds3

About 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one

6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one (PubChem CID 11538083) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one.

Molecular Properties

Compound Name6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one
PubChem CID11538083
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC Name6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one
SMILESCc1ccc(CC2CCN(C(=O)c3cc(=O)c4cc(O)ccc4[nH]3)CC2)cc1
InChIInChI=1S/C23H24N2O3/c1-15-2-4-16(5-3-15)12-17-8-10-25(11-9-17)23(28)21-14-22(27)19-13-18(26)6-7-20(19)24-21/h2-7,13-14,17,26H,8-12H2,1H3,(H,24,27)
InChIKeyNRKFXELBKOAUIH-UHFFFAOYSA-N
XLogP3.64
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Hydroxy-10H-acridin-9-one
CID 436659
Cycloaspeptide A
CID 11296670
2-[4-(4-Fluoro-benzyl)-piperidine-1-carbonyl]-6-hydroxy-1H-quinolin-4-one
CID 11509163
2-[4-(4-Chloro-benzyl)-piperidine-1-carbonyl]-6-hydroxy-1H-quinolin-4-one
CID 11567443
2-(4-Benzyl-piperidine-1-carbonyl)-6-hydroxy-1H-quinolin-4-one
CID 11653435
6-Hydroxy-2-(4-p-tolyloxy-piperidine-1-carbonyl)-1H-quinolin4-one
CID 11710609
4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-N-(4-hydroxyphenyl)benzamide
CID 44564914
8-hydroxy-N-(2-methylphenyl)-4-oxo-1H-quinoline-2-carboxamide
CID 56950525
8-hydroxy-N-(2-methylphenyl)-4-oxo-1H-quinoline-2-carboxamide
CID 56950525
16-[(4-Hydroxyphenyl)amino]-14-methyl-14-azatetracyclo[7.7.1.0^{2,7}.0^{13,17}]heptadeca-1(16),2,4,6,9(17),10,12-heptaene-8,15-dione
CID 1263311
N-[2-(dimethylamino)ethyl]-1-[2-(dimethylamino)ethylamino]-7-hydroxy-9-oxo-10H-acridine-4-carboxamide
CID 10692973

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one?
The IUPAC name of 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one (CID 11538083) is 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one.
What is the SMILES notation for 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one?
The canonical SMILES for 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one is Cc1ccc(CC2CCN(C(=O)c3cc(=O)c4cc(O)ccc4[nH]3)CC2)cc1.
What is the InChIKey of 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one?
The InChIKey is NRKFXELBKOAUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-15-2-4-16(5-3-15)12-17-8-10-25(11-9-17)23(28)21-14-22(27)19-13-18(26)6-7-20(19)24-21/h2-7,13-14,17,26H,8-12H2,1H3,(H,24,27).
What are the key properties of 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one?
6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one has a molecular weight of 376.46 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-2-[4-[(4-methylphenyl)methyl]piperidine-1-carbonyl]-1H-quinolin-4-one is sourced from PubChem (CID 11538083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).