5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide

C18H23N3O3 — CID 72932314

IUPAC5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide
SMILESCNC(=O)c1ccc(CNC(=O)C(c2ccccc2C)N(C)C)o1
InChIInChI=1S/C18H23N3O3/c1-12-7-5-6-8-14(12)16(21(3)4)18(23)20-11-13-9-10-15(24-13)17(22)19-2/h5-10,16H,11H2,1-4H3,(H,19,22)(H,20,23)
InChIKeyRZTXESKJPXGAMU-UHFFFAOYSA-N
MW329.40 g/mol
LogP1.87
Rot. Bonds6

About 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide

5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide (PubChem CID 72932314) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide.

Molecular Properties

Compound Name5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide
PubChem CID72932314
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC Name5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide
SMILESCNC(=O)c1ccc(CNC(=O)C(c2ccccc2C)N(C)C)o1
InChIInChI=1S/C18H23N3O3/c1-12-7-5-6-8-14(12)16(21(3)4)18(23)20-11-13-9-10-15(24-13)17(22)19-2/h5-10,16H,11H2,1-4H3,(H,19,22)(H,20,23)
InChIKeyRZTXESKJPXGAMU-UHFFFAOYSA-N
XLogP1.87
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(acetamidomethyl)-N-[(1S)-2-methyl-1-(2-methylphenyl)propyl]furan-2-carboxamide
CID 96525205
2-(dimethylamino)-N-[(5-ethyl-2-pyridinyl)methyl]-2-(2-methylphenyl)acetamide
CID 72917770
5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]thiophene-2-carboxylic acid
CID 72854905
N-[(2R)-2-(dimethylamino)-2-(2-methylphenyl)ethyl]-5-(methoxymethyl)furan-2-carboxamide
CID 97453798
2-(dimethylamino)-2-(2-methylphenyl)-N-(3-methylsulfanylpropyl)acetamide
CID 72846104
2-(dimethylamino)-2-(2-methylphenyl)-N-[(1-phenyltetrazol-5-yl)methyl]acetamide
CID 72938798
2-(dimethylamino)-2-(2-methylphenyl)-N-[[2-(methylsulfanylmethyl)-1,3-thiazol-4-yl]methyl]acetamide
CID 72859862
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
(2R)-N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-2-(dimethylamino)-2-(2-methylphenyl)acetamide
CID 97209515
(2S)-N-[(4-cyanophenyl)methyl]-2-(dimethylamino)-2-(2-fluorophenyl)acetamide
CID 97129161
5-[[3-(3,5-dimethylphenyl)propanoylamino]methyl]-N-methylfuran-2-carboxamide
CID 50949888
2-(dimethylamino)-2-(2-methylphenyl)-N-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)acetamide
CID 72841553

Frequently Asked Questions

What is the IUPAC name of 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide?
The IUPAC name of 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide (CID 72932314) is 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide.
What is the SMILES notation for 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide?
The canonical SMILES for 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide is CNC(=O)c1ccc(CNC(=O)C(c2ccccc2C)N(C)C)o1.
What is the InChIKey of 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide?
The InChIKey is RZTXESKJPXGAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-12-7-5-6-8-14(12)16(21(3)4)18(23)20-11-13-9-10-15(24-13)17(22)19-2/h5-10,16H,11H2,1-4H3,(H,19,22)(H,20,23).
What are the key properties of 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide?
5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[2-(dimethylamino)-2-(2-methylphenyl)acetyl]amino]methyl]-N-methylfuran-2-carboxamide is sourced from PubChem (CID 72932314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).