2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride

C10H14Cl2N2O2 — CID 119295694

IUPAC2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride
SMILESCl.NCC(=O)NCCOc1cccc(Cl)c1
InChIInChI=1S/C10H13ClN2O2.ClH/c11-8-2-1-3-9(6-8)15-5-4-13-10(14)7-12;/h1-3,6H,4-5,7,12H2,(H,13,14);1H
InChIKeyREYFSZDPZXTRPT-UHFFFAOYSA-N
MW265.14 g/mol
LogP1.22
Rot. Bonds5

About 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride

2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride (PubChem CID 119295694) has the molecular formula C10H14Cl2N2O2 and a molecular weight of 265.14 g/mol. Its IUPAC name is 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride
PubChem CID119295694
Molecular FormulaC10H14Cl2N2O2
Molecular Weight265.14 g/mol
Exact Mass264.04
IUPAC Name2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride
SMILESCl.NCC(=O)NCCOc1cccc(Cl)c1
InChIInChI=1S/C10H13ClN2O2.ClH/c11-8-2-1-3-9(6-8)15-5-4-13-10(14)7-12;/h1-3,6H,4-5,7,12H2,(H,13,14);1H
InChIKeyREYFSZDPZXTRPT-UHFFFAOYSA-N
XLogP1.22
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.14
LogP ≤ 51.22
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

4-amino-N-[2-(3-chlorophenoxy)ethyl]butanamide;hydrochloride
CID 119295708
4-amino-N-[2-(3-chlorophenoxy)ethyl]-3-methoxybutanamide
CID 120589375
2-amino-N-[2-(3-chlorophenoxy)ethyl]propanamide;hydrochloride
CID 119295698
methyl N-[2-(3-chlorophenoxy)ethyl]carbamate
CID 14496172
N-[2-(3-chlorophenoxy)ethyl]acetamide;ethane
CID 177170822
1-amino-N-[2-(3-chlorophenoxy)ethyl]cyclopropane-1-carboxamide
CID 119734966
1-amino-N-[2-(3-chlorophenoxy)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119295699
(2S)-2-amino-N-[2-(3-chlorophenoxy)ethyl]-4-methylpentanamide;hydrochloride
CID 119735014
N-[2-(3-chlorophenoxy)ethyl]-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 110899228
N-[2-(3-chlorophenoxy)ethyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55717207
3-(3-chlorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 43428089
cis-(1R,2S)-N-[2-[2-(3-chlorophenoxy)ethylamino]-2-oxoethyl]-2-methylcyclopropane-1-carboxamide
CID 94182100

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride (CID 119295694) is 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride is Cl.NCC(=O)NCCOc1cccc(Cl)c1.
What is the InChIKey of 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride?
The InChIKey is REYFSZDPZXTRPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2.ClH/c11-8-2-1-3-9(6-8)15-5-4-13-10(14)7-12;/h1-3,6H,4-5,7,12H2,(H,13,14);1H.
What are the key properties of 2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride?
2-amino-N-[2-(3-chlorophenoxy)ethyl]acetamide;hydrochloride has a molecular weight of 265.14 g/mol, XLogP of 1.22, 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-(3-chlorophenoxy)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119295694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).