2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride

C11H17ClN2O2 — CID 119300070

IUPAC2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
SMILESCc1ccccc1OCCNC(=O)CN.Cl
InChIInChI=1S/C11H16N2O2.ClH/c1-9-4-2-3-5-10(9)15-7-6-13-11(14)8-12;/h2-5H,6-8,12H2,1H3,(H,13,14);1H
InChIKeyRDYSZUNFOVETJB-UHFFFAOYSA-N
MW244.72 g/mol
LogP0.87
Rot. Bonds5

About 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride

2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride (PubChem CID 119300070) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
PubChem CID119300070
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC Name2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
SMILESCc1ccccc1OCCNC(=O)CN.Cl
InChIInChI=1S/C11H16N2O2.ClH/c1-9-4-2-3-5-10(9)15-7-6-13-11(14)8-12;/h2-5H,6-8,12H2,1H3,(H,13,14);1H
InChIKeyRDYSZUNFOVETJB-UHFFFAOYSA-N
XLogP0.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(methylamino)-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119742926
4-amino-3-methoxy-N-[2-(2-methylphenoxy)ethyl]butanamide;hydrochloride
CID 120589848
3-amino-N-[2-(2-methylphenoxy)ethyl]-3-phenylpropanamide;hydrochloride
CID 119950402
N-[2-(2-methylphenoxy)ethyl]-3-phenylpropanamide
CID 600522
4-(2-methylphenoxy)-N-[2-(4-methylphenoxy)ethyl]butanamide
CID 19174762
2-(cyclopropylmethylamino)-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119742933
4-(methylamino)-N-[3-(2-methylphenoxy)propyl]butanamide;hydrochloride
CID 119772252
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 18113601
1-ethyl-3-[2-(2-methylphenoxy)ethyl]urea
CID 47307518
N-[2-(2-methylphenoxy)ethyl]-4-phenylbutanamide
CID 60538344
2-cyclopentyl-N-[2-(2-methylphenoxy)ethyl]acetamide
CID 60538479
2-amino-N-[2-(2-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667716

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride (CID 119300070) is 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride is Cc1ccccc1OCCNC(=O)CN.Cl.
What is the InChIKey of 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride?
The InChIKey is RDYSZUNFOVETJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2.ClH/c1-9-4-2-3-5-10(9)15-7-6-13-11(14)8-12;/h2-5H,6-8,12H2,1H3,(H,13,14);1H.
What are the key properties of 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride?
2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride has a molecular weight of 244.72 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119300070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).