5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide

C16H15ClN2O2 — CID 63283438

IUPAC5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
SMILESO=C(Nc1ccc2c(c1)CCCN2)c1cc(Cl)ccc1O
InChIInChI=1S/C16H15ClN2O2/c17-11-3-6-15(20)13(9-11)16(21)19-12-4-5-14-10(8-12)2-1-7-18-14/h3-6,8-9,18,20H,1-2,7H2,(H,19,21)
InChIKeyNYHQISMOBBGCCR-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.66
Rot. Bonds2

About 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide

5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide (PubChem CID 63283438) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
PubChem CID63283438
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC Name5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
SMILESO=C(Nc1ccc2c(c1)CCCN2)c1cc(Cl)ccc1O
InChIInChI=1S/C16H15ClN2O2/c17-11-3-6-15(20)13(9-11)16(21)19-12-4-5-14-10(8-12)2-1-7-18-14/h3-6,8-9,18,20H,1-2,7H2,(H,19,21)
InChIKeyNYHQISMOBBGCCR-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

4-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 63283394
2,4-dichloro-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 63283086
2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 103806053
3-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)pyridine-4-carboxamide
CID 81445909
2,4-dichloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 63252988
2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide;hydrochloride
CID 119547274
3-bromo-5-chloro-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 107939898
5-bromo-2-methyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 65311484
N-(1,2,3,4-tetrahydroquinolin-6-yl)thiadiazole-4-carboxamide;hydrochloride
CID 119547224
2-chloro-5-[[2,2-dichloro-3-(3,5-dichlorophenyl)cyclopropanecarbonyl]amino]-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 122618794
4-chloro-N-(2,3-dihydro-1H-indol-5-yl)-2,5-difluorobenzamide
CID 82771926
3-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 55169715

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide (CID 63283438) is 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide is O=C(Nc1ccc2c(c1)CCCN2)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide?
The InChIKey is NYHQISMOBBGCCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c17-11-3-6-15(20)13(9-11)16(21)19-12-4-5-14-10(8-12)2-1-7-18-14/h3-6,8-9,18,20H,1-2,7H2,(H,19,21).
What are the key properties of 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide?
5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-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 5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide is sourced from PubChem (CID 63283438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).