2-(2,6-dimethylanilino)-3-ethylbenzamide

C17H20N2O — CID 21484509

IUPAC2-(2,6-dimethylanilino)-3-ethylbenzamide
SMILESCCc1cccc(C(N)=O)c1Nc1c(C)cccc1C
InChIInChI=1S/C17H20N2O/c1-4-13-9-6-10-14(17(18)20)16(13)19-15-11(2)7-5-8-12(15)3/h5-10,19H,4H2,1-3H3,(H2,18,20)
InChIKeyLNYUWPQGSZQSSC-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.71
Rot. Bonds4

About 2-(2,6-dimethylanilino)-3-ethylbenzamide

2-(2,6-dimethylanilino)-3-ethylbenzamide (PubChem CID 21484509) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-3-ethylbenzamide.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-3-ethylbenzamide
PubChem CID21484509
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-(2,6-dimethylanilino)-3-ethylbenzamide
SMILESCCc1cccc(C(N)=O)c1Nc1c(C)cccc1C
InChIInChI=1S/C17H20N2O/c1-4-13-9-6-10-14(17(18)20)16(13)19-15-11(2)7-5-8-12(15)3/h5-10,19H,4H2,1-3H3,(H2,18,20)
InChIKeyLNYUWPQGSZQSSC-UHFFFAOYSA-N
XLogP3.71
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-2-(2-ethyl-6-methylanilino)benzamide
CID 61313663
2,3-diethylbenzamide;hydrofluoride
CID 175203586
1-(2-ethyl-6-methylphenyl)-2-methylguanidine
CID 62378878
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
1-(2-ethyl-6-methylphenyl)-3-(N'-methylcarbamimidoyl)urea
CID 3049597
N'-(2-ethyl-6-methylphenyl)butanediamide
CID 82041304
4-(2-ethyl-6-methylanilino)-2,3-difluorobenzenecarbothioamide
CID 107934360
2-(2-ethyl-6-methylanilino)-6-methylpyridine-3-carbothioamide
CID 63513755
(Z)-N'-(2,6-diethylphenyl)-1-(2-methylphenyl)ethene-1,2-diamine
CID 126680511
3-(2-ethyl-6-methylanilino)pyridine-4-carbothioamide
CID 114288025
(E)-N,N'-bis(2-ethyl-6-methylphenyl)but-2-enediamide
CID 17407260
3-carbamothioyl-N-(2-ethyl-6-methylphenyl)benzamide
CID 24697035

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-3-ethylbenzamide?
The IUPAC name of 2-(2,6-dimethylanilino)-3-ethylbenzamide (CID 21484509) is 2-(2,6-dimethylanilino)-3-ethylbenzamide.
What is the SMILES notation for 2-(2,6-dimethylanilino)-3-ethylbenzamide?
The canonical SMILES for 2-(2,6-dimethylanilino)-3-ethylbenzamide is CCc1cccc(C(N)=O)c1Nc1c(C)cccc1C.
What is the InChIKey of 2-(2,6-dimethylanilino)-3-ethylbenzamide?
The InChIKey is LNYUWPQGSZQSSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-4-13-9-6-10-14(17(18)20)16(13)19-15-11(2)7-5-8-12(15)3/h5-10,19H,4H2,1-3H3,(H2,18,20).
What are the key properties of 2-(2,6-dimethylanilino)-3-ethylbenzamide?
2-(2,6-dimethylanilino)-3-ethylbenzamide has a molecular weight of 268.36 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylanilino)-3-ethylbenzamide is sourced from PubChem (CID 21484509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).