2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide

C16H15ClN2O2 — CID 106500914

IUPAC2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide
SMILESO=C(Nc1cccc2c1CCCN2)c1cc(O)ccc1Cl
InChIInChI=1S/C16H15ClN2O2/c17-13-7-6-10(20)9-12(13)16(21)19-15-5-1-4-14-11(15)3-2-8-18-14/h1,4-7,9,18,20H,2-3,8H2,(H,19,21)
InChIKeyTZNXBSCZHGQWMR-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.66
Rot. Bonds2

About 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide

2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide (PubChem CID 106500914) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide.

Molecular Properties

Compound Name2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide
PubChem CID106500914
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC Name2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide
SMILESO=C(Nc1cccc2c1CCCN2)c1cc(O)ccc1Cl
InChIInChI=1S/C16H15ClN2O2/c17-13-7-6-10(20)9-12(13)16(21)19-15-5-1-4-14-11(15)3-2-8-18-14/h1,4-7,9,18,20H,2-3,8H2,(H,19,21)
InChIKeyTZNXBSCZHGQWMR-UHFFFAOYSA-N
XLogP3.66
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(1,2,3,4-tetrahydroquinolin-5-yl)imidazole-4-carboxamide
CID 107971880
N-(3-chloro-2-pyridinyl)-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 103094226
N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide
CID 65018541
N-(1,2,3,4-tetrahydroquinolin-5-yl)piperidine-1-carboxamide
CID 79155006
1,1-diethyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea
CID 79161957
1-propyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea
CID 28786606
N-(2-bromo-5-methylphenyl)-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 82747600
2-chloro-5-hydroxy-N-(2,4,5-trichlorophenyl)benzamide
CID 106501235
2-cycloheptyl-N-(1,2,3,4-tetrahydroquinolin-5-yl)acetamide
CID 114457423
N-(2-bromo-3-chlorophenyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 103479340
2-chloro-N-(2,5-dichloro-4-methylphenyl)-5-hydroxybenzamide
CID 106502134
N-[2-(aminomethyl)phenyl]-2-chloro-5-hydroxybenzamide
CID 106502622

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide?
The IUPAC name of 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide (CID 106500914) is 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide.
What is the SMILES notation for 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide?
The canonical SMILES for 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide is O=C(Nc1cccc2c1CCCN2)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide?
The InChIKey is TZNXBSCZHGQWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c17-13-7-6-10(20)9-12(13)16(21)19-15-5-1-4-14-11(15)3-2-8-18-14/h1,4-7,9,18,20H,2-3,8H2,(H,19,21).
What are the key properties of 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide?
2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide has a molecular weight of 302.76 g/mol, XLogP of 3.66, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydroquinolin-5-yl)benzamide is sourced from PubChem (CID 106500914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).