2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide

C23H20ClNO2 — CID 151285712

IUPAC2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2cccc3c2CCCC3)cc1)c1c(O)cccc1Cl
InChIInChI=1S/C23H20ClNO2/c24-20-9-4-10-21(26)22(20)23(27)25-17-13-11-16(12-14-17)19-8-3-6-15-5-1-2-7-18(15)19/h3-4,6,8-14,26H,1-2,5,7H2,(H,25,27)
InChIKeyNZIMRBBSCUBLKI-UHFFFAOYSA-N
MW377.87 g/mol
LogP5.84
Rot. Bonds3

About 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide

2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide (PubChem CID 151285712) has the molecular formula C23H20ClNO2 and a molecular weight of 377.87 g/mol. Its IUPAC name is 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide
PubChem CID151285712
Molecular FormulaC23H20ClNO2
Molecular Weight377.87 g/mol
Exact Mass377.12
IUPAC Name2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2cccc3c2CCCC3)cc1)c1c(O)cccc1Cl
InChIInChI=1S/C23H20ClNO2/c24-20-9-4-10-21(26)22(20)23(27)25-17-13-11-16(12-14-17)19-8-3-6-15-5-1-2-7-18(15)19/h3-4,6,8-14,26H,1-2,5,7H2,(H,25,27)
InChIKeyNZIMRBBSCUBLKI-UHFFFAOYSA-N
XLogP5.84
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.87
LogP ≤ 55.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-dichloro-N-(4-methylphenyl)benzamide
CID 5152296
ethanol;4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenol
CID 174803468
phosphoric acid;5-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2,3,4-tetrahydronaphthalene
CID 23110735
N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CID 155951507
N-(4-chlorophenyl)-2-hydroxy-6-methylbenzamide
CID 46215145
2,6-dichloro-N-(1,2,3,4-tetrahydroquinolin-7-yl)benzamide
CID 63930601
2,6-dichloro-N-[4-[(6-oxo-7,8,9,10-tetrahydro-5H-benzo[c][1,8]naphthyridin-1-yl)amino]phenyl]benzamide
CID 58564253
2-chloro-6-methyl-N-pyridin-4-ylbenzamide
CID 59618146
N-[4-(2,5-dichlorophenyl)phenyl]-2,6-difluorobenzamide
CID 11222663
3,6-bis(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2,4,5-tetrazine
CID 146453462
2,6-dichloro-N-(6-chloro-3-pyridinyl)benzamide
CID 113247998
2-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CID 147285912

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide?
The IUPAC name of 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide (CID 151285712) is 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide?
The canonical SMILES for 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide is O=C(Nc1ccc(-c2cccc3c2CCCC3)cc1)c1c(O)cccc1Cl.
What is the InChIKey of 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide?
The InChIKey is NZIMRBBSCUBLKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClNO2/c24-20-9-4-10-21(26)22(20)23(27)25-17-13-11-16(12-14-17)19-8-3-6-15-5-1-2-7-18(15)19/h3-4,6,8-14,26H,1-2,5,7H2,(H,25,27).
What are the key properties of 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide?
2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide has a molecular weight of 377.87 g/mol, XLogP of 5.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydroxy-N-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)phenyl]benzamide is sourced from PubChem (CID 151285712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).