N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride

C10H14Cl2N2O — CID 119385267

IUPACN-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride
SMILESCl.NCCNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C10H13ClN2O.ClH/c11-9-3-1-2-8(6-9)7-10(14)13-5-4-12;/h1-3,6H,4-5,7,12H2,(H,13,14);1H
InChIKeyXYXJVBHAHLKRCS-UHFFFAOYSA-N
MW249.14 g/mol
LogP1.38
Rot. Bonds4

About N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride

N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride (PubChem CID 119385267) has the molecular formula C10H14Cl2N2O and a molecular weight of 249.14 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride
PubChem CID119385267
Molecular FormulaC10H14Cl2N2O
Molecular Weight249.14 g/mol
Exact Mass248.05
IUPAC NameN-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride
SMILESCl.NCCNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C10H13ClN2O.ClH/c11-9-3-1-2-8(6-9)7-10(14)13-5-4-12;/h1-3,6H,4-5,7,12H2,(H,13,14);1H
InChIKeyXYXJVBHAHLKRCS-UHFFFAOYSA-N
XLogP1.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.14
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 94684838
2-(3-chlorophenyl)-N-[2-(ethylamino)ethyl]acetamide;hydrochloride
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N-(2-aminoethyl)-2,6-dichloro-3-[[2-(3-chlorophenyl)acetyl]amino]benzamide
CID 167265896
2-(3-chlorophenyl)-N-(3-sulfamoylpropyl)acetamide
CID 62505682
N-(3-aminopropyl)-2-[3-[(3-chlorophenyl)methoxy]phenyl]acetamide
CID 119405733
N-[2-[[2-(3-chlorophenyl)acetyl]amino]ethyl]-2,2,2-trifluoroacetamide
CID 108932591
2-[2-(aminomethyl)phenyl]-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 81313061
N-[2-(2-chloroethoxy)ethyl]-2-(3-chlorophenyl)acetamide
CID 114297493
(2S)-N-(2-aminoethyl)-2-[(3-chlorophenyl)methyl]-3-sulfanylpropanamide
CID 87670182
N-[(4-aminophenyl)methyl]-2-(3-chlorophenyl)acetamide
CID 62503389
2-(3-chlorophenyl)-N-(3-pyrrol-1-ylpropyl)acetamide
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N-(2-aminoethyl)-2-(4-chloro-3-fluorophenyl)acetamide
CID 110832954

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride (CID 119385267) is N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride is Cl.NCCNC(=O)Cc1cccc(Cl)c1.
What is the InChIKey of N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride?
The InChIKey is XYXJVBHAHLKRCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O.ClH/c11-9-3-1-2-8(6-9)7-10(14)13-5-4-12;/h1-3,6H,4-5,7,12H2,(H,13,14);1H.
What are the key properties of N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride?
N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride has a molecular weight of 249.14 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(3-chlorophenyl)acetamide;hydrochloride is sourced from PubChem (CID 119385267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).