N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide

C17H20N2O2 — CID 115377986

IUPACN-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)Nc2ccc(C)c(N(C)C)c2)c1
InChIInChI=1S/C17H20N2O2/c1-11-5-8-16(20)14(9-11)17(21)18-13-7-6-12(2)15(10-13)19(3)4/h5-10,20H,1-4H3,(H,18,21)
InChIKeyNTCMNWBGWVTKKB-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.33
Rot. Bonds3

About N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide

N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide (PubChem CID 115377986) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide
PubChem CID115377986
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)Nc2ccc(C)c(N(C)C)c2)c1
InChIInChI=1S/C17H20N2O2/c1-11-5-8-16(20)14(9-11)17(21)18-13-7-6-12(2)15(10-13)19(3)4/h5-10,20H,1-4H3,(H,18,21)
InChIKeyNTCMNWBGWVTKKB-UHFFFAOYSA-N
XLogP3.33
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)-4-methylphenyl]-5-fluoro-2-hydroxybenzamide
CID 115377989
N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-iodobenzamide
CID 107731795
2,4-diamino-N-[3-(dimethylamino)-4-methylphenyl]benzamide
CID 115375793
N-(1,3-benzodioxol-5-yl)-2-hydroxy-5-methylbenzamide
CID 16573543
N-[4-(diethylamino)phenyl]-2-hydroxy-5-methylbenzamide
CID 39122388
2-bromo-5-[(2-hydroxy-5-methylbenzoyl)amino]benzoic acid
CID 115295861
2-fluoro-4-[(2-hydroxy-5-methylbenzoyl)amino]benzoic acid
CID 103867339
4-amino-N-[3-(dimethylamino)-4-methylphenyl]-2-fluorobenzamide
CID 115375795
2-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-fluorobenzamide
CID 115375820
2-hydroxy-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide
CID 43508388
N-(4-cyanophenyl)-2-hydroxy-5-methylbenzamide
CID 5274068
2-chloro-N-[3-(dimethylamino)-4-methylphenyl]pyridine-3-carboxamide
CID 115376771

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide?
The IUPAC name of N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide (CID 115377986) is N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide.
What is the SMILES notation for N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide?
The canonical SMILES for N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide is Cc1ccc(O)c(C(=O)Nc2ccc(C)c(N(C)C)c2)c1.
What is the InChIKey of N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide?
The InChIKey is NTCMNWBGWVTKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11-5-8-16(20)14(9-11)17(21)18-13-7-6-12(2)15(10-13)19(3)4/h5-10,20H,1-4H3,(H,18,21).
What are the key properties of N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide?
N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 3.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide is sourced from PubChem (CID 115377986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).