N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride

C14H22ClN3O3 — CID 119523805

IUPACN-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride
SMILESCC(C)(CN)NC(=O)CNC(=O)COc1ccccc1.Cl
InChIInChI=1S/C14H21N3O3.ClH/c1-14(2,10-15)17-12(18)8-16-13(19)9-20-11-6-4-3-5-7-11;/h3-7H,8-10,15H2,1-2H3,(H,16,19)(H,17,18);1H
InChIKeyXKCKODVLCUUMAC-UHFFFAOYSA-N
MW315.80 g/mol
LogP0.46
Rot. Bonds7

About N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride

N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride (PubChem CID 119523805) has the molecular formula C14H22ClN3O3 and a molecular weight of 315.80 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride
PubChem CID119523805
Molecular FormulaC14H22ClN3O3
Molecular Weight315.80 g/mol
Exact Mass315.13
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride
SMILESCC(C)(CN)NC(=O)CNC(=O)COc1ccccc1.Cl
InChIInChI=1S/C14H21N3O3.ClH/c1-14(2,10-15)17-12(18)8-16-13(19)9-20-11-6-4-3-5-7-11;/h3-7H,8-10,15H2,1-2H3,(H,16,19)(H,17,18);1H
InChIKeyXKCKODVLCUUMAC-UHFFFAOYSA-N
XLogP0.46
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.80
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-(4-benzoylphenoxy)acetamide
CID 119522817
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxyacetamide;hydrochloride
CID 119605895
N-(1-amino-2-methylpropan-2-yl)-2-(4-ethylphenoxy)acetamide
CID 82354507
N-(2-tert-butylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 112997501
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
N-(2-amino-2-sulfanylideneethyl)-2-phenoxyacetamide
CID 61126897
[2-(4-tert-butylanilino)-2-oxoethyl] 2-[(2-phenoxyacetyl)amino]acetate
CID 42964669
N-(1-amino-2-methylpropan-2-yl)-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119523302
2-(4-propoxyphenoxy)ethyl 2-[(2-phenoxyacetyl)amino]acetate
CID 40778027
N-(1-amino-2-methylpropan-2-yl)-2-(2-ethylphenoxy)acetamide;hydrochloride
CID 119521833
N-(3-aminobutyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 119497991
[2-oxo-2-(2-phenylethylamino)ethyl] 2-[(2-phenoxyacetyl)amino]acetate
CID 55303919

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride (CID 119523805) is N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride is CC(C)(CN)NC(=O)CNC(=O)COc1ccccc1.Cl.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride?
The InChIKey is XKCKODVLCUUMAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3.ClH/c1-14(2,10-15)17-12(18)8-16-13(19)9-20-11-6-4-3-5-7-11;/h3-7H,8-10,15H2,1-2H3,(H,16,19)(H,17,18);1H.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride?
N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride has a molecular weight of 315.80 g/mol, XLogP of 0.46, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-2-[(2-phenoxyacetyl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119523805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).