N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide

C18H22N2O2 — CID 119996389

IUPACN-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide
SMILESCC(CN)CNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-14(11-19)12-20-18(21)13-22-17-10-6-5-9-16(17)15-7-3-2-4-8-15/h2-10,14H,11-13,19H2,1H3,(H,20,21)
InChIKeyVHWIGKQZOJPKAY-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.44
Rot. Bonds7

About N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide

N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide (PubChem CID 119996389) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide
PubChem CID119996389
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide
SMILESCC(CN)CNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-14(11-19)12-20-18(21)13-22-17-10-6-5-9-16(17)15-7-3-2-4-8-15/h2-10,14H,11-13,19H2,1H3,(H,20,21)
InChIKeyVHWIGKQZOJPKAY-UHFFFAOYSA-N
XLogP2.44
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 ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2-methylpropyl)-2-(2-methoxyphenoxy)acetamide
CID 115267431
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
3-methyl-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 9470420
N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide
CID 8923326
N-[(2S)-2-(dimethylamino)-3-phenylpropyl]-2-(2-phenylphenoxy)acetamide
CID 8794949
N-(2-amino-2-ethylbutyl)-2-(2-phenylphenoxy)acetamide
CID 119640180
(2R)-3-methyl-2-[[2-(2-phenylphenoxy)acetyl]amino]butanoic acid
CID 9157386
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
N-(2-amino-1-cyclopropylethyl)-2-(2-phenylphenoxy)acetamide
CID 119613353
2-(2-phenylphenoxy)-N-prop-2-enylacetamide
CID 7971284
N-(1-methoxypropan-2-yl)-2-(2-phenylphenoxy)acetamide
CID 18166557
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide (CID 119996389) is N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide is CC(CN)CNC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide?
The InChIKey is VHWIGKQZOJPKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14(11-19)12-20-18(21)13-22-17-10-6-5-9-16(17)15-7-3-2-4-8-15/h2-10,14H,11-13,19H2,1H3,(H,20,21).
What are the key properties of N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide?
N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide has a molecular weight of 298.39 g/mol, XLogP of 2.44, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 119996389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).