ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane

C21H25NO2 — CID 160768568

IUPACethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane
SMILESC.CC.Cc1ccc2cc(O)c(C(=O)Nc3ccccc3)cc2c1
InChIInChI=1S/C18H15NO2.C2H6.CH4/c1-12-7-8-13-11-17(20)16(10-14(13)9-12)18(21)19-15-5-3-2-4-6-15;1-2;/h2-11,20H,1H3,(H,19,21);1-2H3;1H4
InChIKeyRYZXFZOQFOOFLU-UHFFFAOYSA-N
MW323.44 g/mol
LogP5.77
Rot. Bonds2

About ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane

ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane (PubChem CID 160768568) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane.

Molecular Properties

Compound Nameethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane
PubChem CID160768568
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC Nameethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane
SMILESC.CC.Cc1ccc2cc(O)c(C(=O)Nc3ccccc3)cc2c1
InChIInChI=1S/C18H15NO2.C2H6.CH4/c1-12-7-8-13-11-17(20)16(10-14(13)9-12)18(21)19-15-5-3-2-4-6-15;1-2;/h2-11,20H,1H3,(H,19,21);1-2H3;1H4
InChIKeyRYZXFZOQFOOFLU-UHFFFAOYSA-N
XLogP5.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.44
LogP ≤ 55.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

sodium 3-hydroxy-N-phenylnaphthalene-2-carboxamide
CID 21118656
7-(hydroperoxymethyl)-3-hydroxy-N-phenylnaphthalene-2-carboxamide
CID 20667848
3-hydroxy-7-N-[4-[[4-[[6-hydroxy-7-(phenylcarbamoyl)naphthalene-2-carbonyl]amino]phenyl]methyl]phenyl]-2-N-phenylnaphthalene-2,7-dicarboxamide
CID 19595926
3-methyl-N-phenylnaphthalene-2-carboxamide
CID 90742280
ethane;2-hydroxy-N-phenylbenzamide
CID 54170056
3-hydroxy-N-[4-(methylcarbamoyl)phenyl]naphthalene-2-carboxamide
CID 25469011
3-hydroxy-7-methylnaphthalene-2-carbonyl chloride
CID 91900165
4-(4-aminophenyl)sulfonylaniline;3-hydroxy-N-phenylnaphthalene-2-carboxamide
CID 70504923
5-methyl-2-(4-methylphenyl)-N-phenylbenzamide
CID 173213744
3-hydroxy-N-(4-methyl-2-nitrophenyl)naphthalene-2-carboxamide
CID 598391
2-hydroxy-N-phenylbenzamide
CID 157209959
N-[3-(dimethylamino)phenyl]methanesulfonamide;3-hydroxy-N-phenylnaphthalene-2-carboxamide
CID 90862263

Frequently Asked Questions

What is the IUPAC name of ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane?
The IUPAC name of ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane (CID 160768568) is ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane.
What is the SMILES notation for ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane?
The canonical SMILES for ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane is C.CC.Cc1ccc2cc(O)c(C(=O)Nc3ccccc3)cc2c1.
What is the InChIKey of ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane?
The InChIKey is RYZXFZOQFOOFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2.C2H6.CH4/c1-12-7-8-13-11-17(20)16(10-14(13)9-12)18(21)19-15-5-3-2-4-6-15;1-2;/h2-11,20H,1H3,(H,19,21);1-2H3;1H4.
What are the key properties of ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane?
ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane has a molecular weight of 323.44 g/mol, XLogP of 5.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-hydroxy-7-methyl-N-phenylnaphthalene-2-carboxamide;methane is sourced from PubChem (CID 160768568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).