3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide

C19H22N2O3 — CID 75392218

IUPAC3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NC(C)(C)CO)cc1NC(=O)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-13-9-10-15(18(24)21-19(2,3)12-22)11-16(13)20-17(23)14-7-5-4-6-8-14/h4-11,22H,12H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyHYOSLNSTOWEKPD-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.75
Rot. Bonds5

About 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide

3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide (PubChem CID 75392218) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide.

Molecular Properties

Compound Name3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide
PubChem CID75392218
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NC(C)(C)CO)cc1NC(=O)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-13-9-10-15(18(24)21-19(2,3)12-22)11-16(13)20-17(23)14-7-5-4-6-8-14/h4-11,22H,12H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyHYOSLNSTOWEKPD-UHFFFAOYSA-N
XLogP2.75
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-benzamido-N-[2-(tert-butylcarbamoyl)phenyl]-4-methylbenzamide
CID 17226566
3-benzamido-N,4-dimethylbenzamide
CID 17226324
3-benzamido-4-methyl-N-[4-(propanoylamino)phenyl]benzamide
CID 55788298
3-benzamido-4-methyl-N-pentylbenzamide
CID 17226355
3-benzamido-N-(2-cyanophenyl)-4-methylbenzamide
CID 17226453
4-hydroxy-N-(1-hydroxy-2-methylpropan-2-yl)-3-methylbenzamide
CID 103957694
N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
CID 639967
3-benzamido-N-(2,3-dichlorophenyl)-4-methylbenzamide
CID 17226451
(2S)-2-[(3-benzamido-4-methylbenzoyl)amino]-3-methylbutanoic acid
CID 119360446
3-benzamido-4-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 46411335
3-benzamido-4-methyl-N,N-dipropylbenzamide
CID 17226384
N-[[4-(aminomethyl)phenyl]methyl]-3-benzamido-4-methylbenzamide
CID 23968860

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide?
The IUPAC name of 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide (CID 75392218) is 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide.
What is the SMILES notation for 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide?
The canonical SMILES for 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide is Cc1ccc(C(=O)NC(C)(C)CO)cc1NC(=O)c1ccccc1.
What is the InChIKey of 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide?
The InChIKey is HYOSLNSTOWEKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13-9-10-15(18(24)21-19(2,3)12-22)11-16(13)20-17(23)14-7-5-4-6-8-14/h4-11,22H,12H2,1-3H3,(H,20,23)(H,21,24).
What are the key properties of 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide?
3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide has a molecular weight of 326.40 g/mol, XLogP of 2.75, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(1-hydroxy-2-methylpropan-2-yl)-4-methylbenzamide is sourced from PubChem (CID 75392218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).