2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide

C19H24N2O3 — CID 110026311

IUPAC2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide
SMILESCN(CC(C)(CO)CO)C(=O)c1ccccc1Nc1ccccc1
InChIInChI=1S/C19H24N2O3/c1-19(13-22,14-23)12-21(2)18(24)16-10-6-7-11-17(16)20-15-8-4-3-5-9-15/h3-11,20,22-23H,12-14H2,1-2H3
InChIKeyFYWCZUDXMZDCGB-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.49
Rot. Bonds7

About 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide

2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide (PubChem CID 110026311) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide.

Molecular Properties

Compound Name2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide
PubChem CID110026311
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide
SMILESCN(CC(C)(CO)CO)C(=O)c1ccccc1Nc1ccccc1
InChIInChI=1S/C19H24N2O3/c1-19(13-22,14-23)12-21(2)18(24)16-10-6-7-11-17(16)20-15-8-4-3-5-9-15/h3-11,20,22-23H,12-14H2,1-2H3
InChIKeyFYWCZUDXMZDCGB-UHFFFAOYSA-N
XLogP2.49
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-2-(4-methoxyanilino)-N-methylbenzamide
CID 111663042
N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methyl-2-(N-methylanilino)benzamide
CID 110026257
2-anilino-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 2533639
2-anilino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 31848474
2-anilino-N-[2-(2-fluorophenoxy)ethyl]-N-methylbenzamide
CID 31665595
bis(2-anilinophenyl)methanone
CID 141301141
1-[2-[(2-anilinobenzoyl)-methylamino]acetyl]piperidine-4-carboxylic acid
CID 119236397
2-anilinobenzoic acid;N-phenylaniline
CID 68732454
2-(tert-butylamino)-N-ethyl-N-methylbenzamide
CID 18630229
2-(4-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide
CID 55720016
2-[4-(dimethylcarbamoyl)anilino]benzoic acid
CID 51066170
2-bromo-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N,5-dimethylbenzamide
CID 100681249

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide?
The IUPAC name of 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide (CID 110026311) is 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide.
What is the SMILES notation for 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide?
The canonical SMILES for 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide is CN(CC(C)(CO)CO)C(=O)c1ccccc1Nc1ccccc1.
What is the InChIKey of 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide?
The InChIKey is FYWCZUDXMZDCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-19(13-22,14-23)12-21(2)18(24)16-10-6-7-11-17(16)20-15-8-4-3-5-9-15/h3-11,20,22-23H,12-14H2,1-2H3.
What are the key properties of 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide?
2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide has a molecular weight of 328.41 g/mol, XLogP of 2.49, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[3-hydroxy-2-(hydroxymethyl)-2-methylpropyl]-N-methylbenzamide is sourced from PubChem (CID 110026311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).