N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide

C13H19ClN2O2 — CID 119524681

IUPACN-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide
SMILESCc1c(Cl)cccc1OCC(=O)NC(C)(C)CN
InChIInChI=1S/C13H19ClN2O2/c1-9-10(14)5-4-6-11(9)18-7-12(17)16-13(2,3)8-15/h4-6H,7-8,15H2,1-3H3,(H,16,17)
InChIKeyLWCJXPZXEHCQMD-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.88
Rot. Bonds5

About N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide

N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide (PubChem CID 119524681) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide
PubChem CID119524681
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide
SMILESCc1c(Cl)cccc1OCC(=O)NC(C)(C)CN
InChIInChI=1S/C13H19ClN2O2/c1-9-10(14)5-4-6-11(9)18-7-12(17)16-13(2,3)8-15/h4-6H,7-8,15H2,1-3H3,(H,16,17)
InChIKeyLWCJXPZXEHCQMD-UHFFFAOYSA-N
XLogP1.88
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119523302
N-(1-amino-2-methylpropan-2-yl)-2-(2-methylphenoxy)acetamide
CID 110834301
N-(1-amino-2-methylpropan-2-yl)-2-(2-ethoxyphenoxy)acetamide
CID 119522316
N-(1-amino-2-methylpropan-2-yl)-2-(2-tert-butylphenoxy)acetamide
CID 119523420
N-(1-amino-2-methylpropan-2-yl)-2-(2,4,5-trichlorophenoxy)acetamide;hydrochloride
CID 119524297
N-(1-amino-2-methylpropan-2-yl)-2-(2,6-dichlorophenyl)acetamide
CID 119524754
N-(1-amino-2-methylpropan-2-yl)-2-(2-ethylphenoxy)acetamide;hydrochloride
CID 119521833
2-(2,3-dimethylphenoxy)-N-(4-hydroxy-2-methylbutan-2-yl)acetamide
CID 115968921
[2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 8581903
2-[[2-(3-chloro-2-methylphenoxy)acetyl]amino]-3-methylbutanoic acid
CID 119170393
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-chlorophenoxy)acetamide;hydrochloride
CID 119598961
N-(1-amino-2-methylpropan-2-yl)-3-(2-bromophenoxy)propanamide
CID 119521510

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide (CID 119524681) is N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide is Cc1c(Cl)cccc1OCC(=O)NC(C)(C)CN.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide?
The InChIKey is LWCJXPZXEHCQMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-9-10(14)5-4-6-11(9)18-7-12(17)16-13(2,3)8-15/h4-6H,7-8,15H2,1-3H3,(H,16,17).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide?
N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide has a molecular weight of 270.76 g/mol, XLogP of 1.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-2-(3-chloro-2-methylphenoxy)acetamide is sourced from PubChem (CID 119524681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).