5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide

C16H15ClN2O2 — CID 62494221

IUPAC5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide
SMILESNC(=O)c1cc(Cl)ccc1Oc1cccc2c1NCCC2
InChIInChI=1S/C16H15ClN2O2/c17-11-6-7-13(12(9-11)16(18)20)21-14-5-1-3-10-4-2-8-19-15(10)14/h1,3,5-7,9,19H,2,4,8H2,(H2,18,20)
InChIKeyBTKYTDUCFFBIBZ-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.59
Rot. Bonds3

About 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide

5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide (PubChem CID 62494221) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide.

Molecular Properties

Compound Name5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide
PubChem CID62494221
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC Name5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide
SMILESNC(=O)c1cc(Cl)ccc1Oc1cccc2c1NCCC2
InChIInChI=1S/C16H15ClN2O2/c17-11-6-7-13(12(9-11)16(18)20)21-14-5-1-3-10-4-2-8-19-15(10)14/h1,3,5-7,9,19H,2,4,8H2,(H2,18,20)
InChIKeyBTKYTDUCFFBIBZ-UHFFFAOYSA-N
XLogP3.59
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-(2,4-dichlorophenoxy)-1,2,3,4-tetrahydroquinoline
CID 139601365
8-[(5-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 54907879
8-pyridin-4-yloxy-1,2,3,4-tetrahydroquinoline
CID 54908431
2-fluoro-6-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzonitrile
CID 61026238
8-[(5-bromo-3-chloro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 103582950
methyl 4-(1,2,3,4-tetrahydroquinolin-8-yloxy)pyridine-2-carboxylate
CID 66286325
8-(5-fluoro-2-nitrophenoxy)-1,2,3,4-tetrahydroquinoline
CID 62378003
3,5-difluoro-4-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzonitrile
CID 81285817
8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline
CID 61025631
(5-chloro-2-methoxyphenyl)-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 116554437
8-[(3,5-difluoro-2-pyridinyl)oxy]-1,2,3,4-tetrahydroquinoline
CID 112676286
2-(2-amino-5-chlorophenoxy)benzamide
CID 113315871

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide?
The IUPAC name of 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide (CID 62494221) is 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide.
What is the SMILES notation for 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide?
The canonical SMILES for 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide is NC(=O)c1cc(Cl)ccc1Oc1cccc2c1NCCC2.
What is the InChIKey of 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide?
The InChIKey is BTKYTDUCFFBIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c17-11-6-7-13(12(9-11)16(18)20)21-14-5-1-3-10-4-2-8-19-15(10)14/h1,3,5-7,9,19H,2,4,8H2,(H2,18,20).
What are the key properties of 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide?
5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide has a molecular weight of 302.76 g/mol, XLogP of 3.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)benzamide is sourced from PubChem (CID 62494221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).