N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride

C15H25ClN2O2 — CID 119607770

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride
SMILESCc1cccc(OCC(=O)NC(C)(CN)C(C)C)c1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11(2)15(4,10-16)17-14(18)9-19-13-7-5-6-12(3)8-13;/h5-8,11H,9-10,16H2,1-4H3,(H,17,18);1H
InChIKeyJNCCPSXGPUMPCN-UHFFFAOYSA-N
MW300.83 g/mol
LogP2.29
Rot. Bonds6

About N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride

N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride (PubChem CID 119607770) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride
PubChem CID119607770
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride
SMILESCc1cccc(OCC(=O)NC(C)(CN)C(C)C)c1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-11(2)15(4,10-16)17-14(18)9-19-13-7-5-6-12(3)8-13;/h5-8,11H,9-10,16H2,1-4H3,(H,17,18);1H
InChIKeyJNCCPSXGPUMPCN-UHFFFAOYSA-N
XLogP2.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenoxyacetamide;hydrochloride
CID 119605895
N-(1-amino-2,3-dimethylbutan-2-yl)-2-naphthalen-2-yloxyacetamide
CID 119605476
N-(1-aminopropan-2-yl)-2-(3-methylphenoxy)acetamide
CID 110834120
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119606176
[2-(tert-butylamino)-2-oxoethyl] 2-(3-methylphenoxy)acetate
CID 8910462
3-methyl-3-[[2-(3-methylphenoxy)acetyl]amino]butanoic acid
CID 64672898
[2-[[(2S)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-(3-methylphenoxy)acetate
CID 41466460
N-(3-amino-2-methylpropyl)-2-(3-methylphenoxy)acetamide
CID 119998062
N-methyl-2-(3-methylphenoxy)acetamide
CID 15943355
N-(3-aminobutyl)-2-(3-methylphenoxy)acetamide;hydrochloride
CID 119497988
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(4-chloro-2-methylphenoxy)acetamide;hydrochloride
CID 119605461
N-[2-(methylamino)propyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 120828955

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride (CID 119607770) is N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride is Cc1cccc(OCC(=O)NC(C)(CN)C(C)C)c1.Cl.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride?
The InChIKey is JNCCPSXGPUMPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-11(2)15(4,10-16)17-14(18)9-19-13-7-5-6-12(3)8-13;/h5-8,11H,9-10,16H2,1-4H3,(H,17,18);1H.
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride?
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-methylphenoxy)acetamide;hydrochloride is sourced from PubChem (CID 119607770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).