N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide

C18H22N2O2 — CID 119382324

IUPACN-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide
SMILESCc1ccccc1COc1cccc(CC(=O)NCCN)c1
InChIInChI=1S/C18H22N2O2/c1-14-5-2-3-7-16(14)13-22-17-8-4-6-15(11-17)12-18(21)20-10-9-19/h2-8,11H,9-10,12-13,19H2,1H3,(H,20,21)
InChIKeyXVWOPIWUROSUTB-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.19
Rot. Bonds7

About N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide

N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide (PubChem CID 119382324) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide
PubChem CID119382324
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide
SMILESCc1ccccc1COc1cccc(CC(=O)NCCN)c1
InChIInChI=1S/C18H22N2O2/c1-14-5-2-3-7-16(14)13-22-17-8-4-6-15(11-17)12-18(21)20-10-9-19/h2-8,11H,9-10,12-13,19H2,1H3,(H,20,21)
InChIKeyXVWOPIWUROSUTB-UHFFFAOYSA-N
XLogP2.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide;hydrochloride
CID 119405187
N-(3-hydroxybutyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide
CID 111433717
4-methoxy-2-[[2-[3-[(2-methylphenyl)methoxy]phenyl]acetyl]amino]butanoic acid
CID 120703020
2-[3-[(2,6-dimethylphenyl)methoxy]phenyl]-N-(2-hydroxyethyl)acetamide
CID 15949136
2-[3-[(2-methylphenyl)methoxy]phenyl]-N-(3-piperazin-1-ylpropyl)acetamide;hydrochloride
CID 119390993
N-(2-hydroxyethyl)-2-[4-[(2-methylphenyl)methoxy]phenyl]acetamide
CID 111112371
N-methyl-1-[3-[(2-methylphenyl)methoxy]phenyl]methanamine
CID 19744687
N-(3-aminopropyl)-2-[3-[(3-chlorophenyl)methoxy]phenyl]acetamide
CID 119405733
N-[[3-[(2-methylphenyl)methoxy]phenyl]methyl]propan-1-amine
CID 39368953
N-[2-(3-methoxyphenyl)ethyl]-2-(3-phenylmethoxyphenyl)acetamide
CID 13406973
4-methyl-2-[[3-[(2-methylphenyl)methoxy]phenyl]methylamino]pentanoic acid
CID 66528160
1-[3-[(2-methylphenyl)methoxy]phenyl]ethanone
CID 765227

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide?
The IUPAC name of N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide (CID 119382324) is N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide is Cc1ccccc1COc1cccc(CC(=O)NCCN)c1.
What is the InChIKey of N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide?
The InChIKey is XVWOPIWUROSUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14-5-2-3-7-16(14)13-22-17-8-4-6-15(11-17)12-18(21)20-10-9-19/h2-8,11H,9-10,12-13,19H2,1H3,(H,20,21).
What are the key properties of N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide?
N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide has a molecular weight of 298.39 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-[3-[(2-methylphenyl)methoxy]phenyl]acetamide is sourced from PubChem (CID 119382324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).