3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide

C18H15NO3 — CID 24950040

IUPAC3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1cc(O)cc(-c2ccc3cc(O)ccc3c2)c1
InChIInChI=1S/C18H15NO3/c1-19-18(22)15-7-14(9-17(21)10-15)12-2-3-13-8-16(20)5-4-11(13)6-12/h2-10,20-21H,1H3,(H,19,22)
InChIKeyHDDSUUBNAHYZRO-UHFFFAOYSA-N
MW293.32 g/mol
LogP3.28
Rot. Bonds2

About 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide

3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide (PubChem CID 24950040) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide.

Molecular Properties

Compound Name3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide
PubChem CID24950040
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide
SMILESCNC(=O)c1cc(O)cc(-c2ccc3cc(O)ccc3c2)c1
InChIInChI=1S/C18H15NO3/c1-19-18(22)15-7-14(9-17(21)10-15)12-2-3-13-8-16(20)5-4-11(13)6-12/h2-10,20-21H,1H3,(H,19,22)
InChIKeyHDDSUUBNAHYZRO-UHFFFAOYSA-N
XLogP3.28
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide?
The IUPAC name of 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide (CID 24950040) is 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide.
What is the SMILES notation for 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide?
The canonical SMILES for 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide is CNC(=O)c1cc(O)cc(-c2ccc3cc(O)ccc3c2)c1.
What is the InChIKey of 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide?
The InChIKey is HDDSUUBNAHYZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-19-18(22)15-7-14(9-17(21)10-15)12-2-3-13-8-16(20)5-4-11(13)6-12/h2-10,20-21H,1H3,(H,19,22).
What are the key properties of 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide?
3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide has a molecular weight of 293.32 g/mol, XLogP of 3.28, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide is sourced from PubChem (CID 24950040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).