5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one

C20H20N2O2 — CID 11695444

IUPAC5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one
SMILESO=c1ccc2c(CCNC3Cc4ccccc4C3)ccc(O)c2[nH]1
InChIInChI=1S/C20H20N2O2/c23-18-7-5-13(17-6-8-19(24)22-20(17)18)9-10-21-16-11-14-3-1-2-4-15(14)12-16/h1-8,16,21,23H,9-12H2,(H,22,24)
InChIKeyDLKKKTHWBHCLBY-UHFFFAOYSA-N
MW320.39 g/mol
LogP2.53
Rot. Bonds4

About 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one

5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one (PubChem CID 11695444) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one
PubChem CID11695444
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one
SMILESO=c1ccc2c(CCNC3Cc4ccccc4C3)ccc(O)c2[nH]1
InChIInChI=1S/C20H20N2O2/c23-18-7-5-13(17-6-8-19(24)22-20(17)18)9-10-21-16-11-14-3-1-2-4-15(14)12-16/h1-8,16,21,23H,9-12H2,(H,22,24)
InChIKeyDLKKKTHWBHCLBY-UHFFFAOYSA-N
XLogP2.53
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-[(5,6-diethyl-2,3-dihydro-1H-inden-2-yl)amino]ethyl]-8-hydroxy-1H-quinolin-2-one;2-hydroxyacetic acid
CID 68877343
8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one
CID 70411248
5-[2-[(4,7-diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one
CID 16738802
5-[(1R)-2-[[5-ethyl-6-(2,2,2-trideuterioethyl)-2,3-dihydro-1H-inden-2-yl]amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one
CID 163322006
5-[2-[2-[4-[2-(1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]phenoxy]ethylamino]ethyl]-8-hydroxy-1H-quinolin-2-one
CID 135139061
(Z)-but-2-enedioic acid;5-[(1R)-2-[(5,6-diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one;2-hydroxyacetic acid
CID 68877012
8-hydroxy-5-[(1R)-1-hydroxy-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]-1H-quinolin-2-one
CID 90853876
5-[(1R)-2-[(2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-6-yl)amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one
CID 11405892
3-[2-(4-chlorophenyl)ethylamino]-N-cyclohexyl-N-[2-[2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethylamino]ethyl]propanamide
CID 24959989
3-(2,3-dihydro-1H-inden-2-ylamino)propan-1-ol
CID 3030975
5-bromo-8-hydroxy-1H-quinolin-2-one
CID 71742507
8-hydroxy-5-[(1R)-1-hydroxy-2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one
CID 140957131

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one?
The IUPAC name of 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one (CID 11695444) is 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one is O=c1ccc2c(CCNC3Cc4ccccc4C3)ccc(O)c2[nH]1.
What is the InChIKey of 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one?
The InChIKey is DLKKKTHWBHCLBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c23-18-7-5-13(17-6-8-19(24)22-20(17)18)9-10-21-16-11-14-3-1-2-4-15(14)12-16/h1-8,16,21,23H,9-12H2,(H,22,24).
What are the key properties of 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one?
5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one has a molecular weight of 320.39 g/mol, XLogP of 2.53, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 11695444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).