5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide

C15H24N2O2 — CID 102705204

IUPAC5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide
SMILESCCN(C(=O)c1cc(N)c(C)cc1C)C(C)COC
InChIInChI=1S/C15H24N2O2/c1-6-17(12(4)9-19-5)15(18)13-8-14(16)11(3)7-10(13)2/h7-8,12H,6,9,16H2,1-5H3
InChIKeyWGBIMAYTJYXDPO-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.38
Rot. Bonds5

About 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide

5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide (PubChem CID 102705204) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide.

Molecular Properties

Compound Name5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide
PubChem CID102705204
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide
SMILESCCN(C(=O)c1cc(N)c(C)cc1C)C(C)COC
InChIInChI=1S/C15H24N2O2/c1-6-17(12(4)9-19-5)15(18)13-8-14(16)11(3)7-10(13)2/h7-8,12H,6,9,16H2,1-5H3
InChIKeyWGBIMAYTJYXDPO-UHFFFAOYSA-N
XLogP2.38
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-chloro-N-ethyl-N-(1-methoxypropan-2-yl)benzamide
CID 61107492
5-amino-N-(2-methoxyethyl)-2,4-dimethyl-N-(2-methylpropyl)benzamide
CID 102705195
5-amino-2,4-dimethyl-N,N-bis(2-methylpropyl)benzamide
CID 102705085
2-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-methylbenzamide
CID 62508733
3,5-dibromo-N-ethyl-N-(1-methoxypropan-2-yl)benzamide
CID 103908083
5-bromo-N-ethyl-N-(1-methoxypropan-2-yl)-4-methylthiophene-2-carboxamide
CID 79929205
4-amino-3,5-dichloro-N-ethyl-N-(1-methoxypropan-2-yl)benzamide
CID 82833134
2-[ethyl(1-methoxypropan-2-yl)carbamoyl]-4-methylbenzenesulfonyl chloride
CID 65454499
2-methoxyethyl 5-amino-2,4-dimethylbenzoate
CID 104538496
N-ethyl-4-hydroxy-N-(1-methoxypropan-2-yl)benzamide
CID 55008658
N-ethyl-2-fluoro-N-(1-methoxypropan-2-yl)-5-sulfanylbenzamide
CID 107026683
6-bromo-N-ethyl-N-(1-methoxypropan-2-yl)naphthalene-2-carboxamide
CID 115283107

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide?
The IUPAC name of 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide (CID 102705204) is 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide.
What is the SMILES notation for 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide?
The canonical SMILES for 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide is CCN(C(=O)c1cc(N)c(C)cc1C)C(C)COC.
What is the InChIKey of 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide?
The InChIKey is WGBIMAYTJYXDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-6-17(12(4)9-19-5)15(18)13-8-14(16)11(3)7-10(13)2/h7-8,12H,6,9,16H2,1-5H3.
What are the key properties of 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide?
5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide has a molecular weight of 264.37 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-ethyl-N-(1-methoxypropan-2-yl)-2,4-dimethylbenzamide is sourced from PubChem (CID 102705204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).