3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide

C19H22N2O3 — CID 71860822

IUPAC3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide
SMILESCNC(=O)c1cccc(C(=O)NC(C)(COC)c2ccccc2)c1
InChIInChI=1S/C19H22N2O3/c1-19(13-24-3,16-10-5-4-6-11-16)21-18(23)15-9-7-8-14(12-15)17(22)20-2/h4-12H,13H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyGWUBYZXVJGQEIV-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.34
Rot. Bonds6

About 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide

3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide (PubChem CID 71860822) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide
PubChem CID71860822
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide
SMILESCNC(=O)c1cccc(C(=O)NC(C)(COC)c2ccccc2)c1
InChIInChI=1S/C19H22N2O3/c1-19(13-24-3,16-10-5-4-6-11-16)21-18(23)15-9-7-8-14(12-15)17(22)20-2/h4-12H,13H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyGWUBYZXVJGQEIV-UHFFFAOYSA-N
XLogP2.34
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-methoxy-2-phenylpropan-2-yl]-1,2-oxazole-3-carboxamide
CID 96560012
N-[(2S)-1-methoxy-2-phenylpropan-2-yl]-2-methyl-1H-pyrrole-3-carboxamide
CID 97066107
2-(3-hydroxyphenyl)-N-(1-methoxy-2-phenylpropan-2-yl)acetamide
CID 75518765
N-(1-amino-2-phenylpropan-2-yl)-3-fluorobenzamide
CID 105060344
N-[(2R)-1-methoxy-2-phenylpropan-2-yl]-1-methyl-3-propan-2-ylpyrazole-5-carboxamide
CID 96560022
N-(4-methyl-2-phenylpentan-2-yl)benzamide
CID 91484527
N-(1-chloro-2-phenylpropan-2-yl)-3-cyanobenzamide
CID 105059815
tert-butyl 3-(methylcarbamoyl)benzoate
CID 138647614
3-N-(1-amino-2,3-dimethylbutan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide
CID 119609065
N-methylbenzamide
CID 11954
N-[(2R)-1-methoxy-2-phenylpropan-2-yl]-3-[(2R)-oxolan-2-yl]propanamide
CID 96559972
3-N-(2-amino-2-methylpropyl)-1-N-methylbenzene-1,3-dicarboxamide;hydrochloride
CID 119630742

Frequently Asked Questions

What is the IUPAC name of 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide?
The IUPAC name of 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide (CID 71860822) is 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide is CNC(=O)c1cccc(C(=O)NC(C)(COC)c2ccccc2)c1.
What is the InChIKey of 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide?
The InChIKey is GWUBYZXVJGQEIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-19(13-24-3,16-10-5-4-6-11-16)21-18(23)15-9-7-8-14(12-15)17(22)20-2/h4-12H,13H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide?
3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(1-methoxy-2-phenylpropan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide is sourced from PubChem (CID 71860822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).