2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide

C19H24N2O3 — CID 118767250

IUPAC2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCc2cc(C)ccc2C)c(OCCN)c1
InChIInChI=1S/C19H24N2O3/c1-13-4-5-14(2)15(10-13)12-21-19(22)17-7-6-16(23-3)11-18(17)24-9-8-20/h4-7,10-11H,8-9,12,20H2,1-3H3,(H,21,22)
InChIKeyCRKFELSWKYIZNP-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.58
Rot. Bonds7

About 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide

2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide (PubChem CID 118767250) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide
PubChem CID118767250
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCc2cc(C)ccc2C)c(OCCN)c1
InChIInChI=1S/C19H24N2O3/c1-13-4-5-14(2)15(10-13)12-21-19(22)17-7-6-16(23-3)11-18(17)24-9-8-20/h4-7,10-11H,8-9,12,20H2,1-3H3,(H,21,22)
InChIKeyCRKFELSWKYIZNP-UHFFFAOYSA-N
XLogP2.58
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-aminoethoxy)-N-[(4,6-dimethyl-3-pyridinyl)methyl]-4-methoxybenzamide
CID 119062916
2-(2-aminoethoxy)-N-[(2,5-difluorophenyl)methyl]-4-methoxybenzamide
CID 118769430
2-(2-aminoethoxy)-4-methoxy-N-[(2-methyl-3H-benzimidazol-5-yl)methyl]benzamide
CID 118763514
N-(2-aminoethyl)-4-methoxy-2-methylbenzamide;hydrochloride
CID 119384390
5-amino-N-[[2-(2-methoxyethoxy)-4-methylphenyl]methyl]-2-methylbenzamide
CID 120637316
2,4-dimethoxy-N-[3-(3-methylphenoxy)propyl]benzamide
CID 27039874
2-(2-aminoethoxy)-4-methylbenzamide
CID 62349382
N-[2-(2-aminoethoxy)ethyl]-2-(2,5-dimethylphenyl)acetamide
CID 63756094
N-[(2,4-dimethylphenyl)methyl]-4-methoxybenzamide
CID 3289325
2-[2-(2,5-dimethylphenyl)-2-oxoethoxy]-4-methoxybenzamide
CID 47014341
2,4-dimethoxy-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 38533824
N-[(2,4-dimethoxyphenyl)methyl]-2-iodo-3-methylbenzamide
CID 46453624

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide?
The IUPAC name of 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide (CID 118767250) is 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide is COc1ccc(C(=O)NCc2cc(C)ccc2C)c(OCCN)c1.
What is the InChIKey of 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide?
The InChIKey is CRKFELSWKYIZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-13-4-5-14(2)15(10-13)12-21-19(22)17-7-6-16(23-3)11-18(17)24-9-8-20/h4-7,10-11H,8-9,12,20H2,1-3H3,(H,21,22).
What are the key properties of 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide?
2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide has a molecular weight of 328.41 g/mol, XLogP of 2.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-[(2,5-dimethylphenyl)methyl]-4-methoxybenzamide is sourced from PubChem (CID 118767250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).