3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide

C20H26N2O — CID 109019154

IUPAC3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide
SMILESCCc1cccc(C)c1NCCC(=O)NCc1ccccc1C
InChIInChI=1S/C20H26N2O/c1-4-17-11-7-9-16(3)20(17)21-13-12-19(23)22-14-18-10-6-5-8-15(18)2/h5-11,21H,4,12-14H2,1-3H3,(H,22,23)
InChIKeyRQIADXLBESNRJF-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.98
Rot. Bonds7

About 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide

3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide (PubChem CID 109019154) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide
PubChem CID109019154
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide
SMILESCCc1cccc(C)c1NCCC(=O)NCc1ccccc1C
InChIInChI=1S/C20H26N2O/c1-4-17-11-7-9-16(3)20(17)21-13-12-19(23)22-14-18-10-6-5-8-15(18)2/h5-11,21H,4,12-14H2,1-3H3,(H,22,23)
InChIKeyRQIADXLBESNRJF-UHFFFAOYSA-N
XLogP3.98
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-ethyl-6-methylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022011
3-(2-ethyl-6-methylanilino)-N-(pyridin-2-ylmethyl)propanamide
CID 109023219
N-butyl-3-(2-ethyl-6-methylanilino)propanamide
CID 109012269
N'-(2-ethyl-6-methylphenyl)-N-[(2-methylphenyl)methyl]propanediamide
CID 108945437
3-(2-fluoroanilino)-N-[(2-methylphenyl)methyl]propanamide
CID 109019162
3-(2-ethyl-6-methylanilino)-N-(4-methylphenyl)propanamide
CID 109034345
N-(2-bromophenyl)-3-(2-ethyl-6-methylanilino)propanamide
CID 109036681
3-(2,6-diethylanilino)-N-[(3-methylphenyl)methyl]propanamide
CID 109019490
3-(2-ethyl-6-methylanilino)-N-(2-methoxyphenyl)propanamide
CID 109036653
2-chloro-N-[(2-methylphenyl)methyl]acetamide
CID 9291148
N-[(2-chlorophenyl)methyl]-3-[(2-methylphenyl)methylamino]propanamide
CID 109019248
3-(2,6-dimethylanilino)-N-(pyridin-2-ylmethyl)propanamide
CID 109023214

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide?
The IUPAC name of 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide (CID 109019154) is 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide.
What is the SMILES notation for 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide?
The canonical SMILES for 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide is CCc1cccc(C)c1NCCC(=O)NCc1ccccc1C.
What is the InChIKey of 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide?
The InChIKey is RQIADXLBESNRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-4-17-11-7-9-16(3)20(17)21-13-12-19(23)22-14-18-10-6-5-8-15(18)2/h5-11,21H,4,12-14H2,1-3H3,(H,22,23).
What are the key properties of 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide?
3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide has a molecular weight of 310.44 g/mol, XLogP of 3.98, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethyl-6-methylanilino)-N-[(2-methylphenyl)methyl]propanamide is sourced from PubChem (CID 109019154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).