2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride

C10H14Cl2N2O — CID 119268984

IUPAC2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride
SMILESCC(NC(=O)CN)c1ccccc1Cl.Cl
InChIInChI=1S/C10H13ClN2O.ClH/c1-7(13-10(14)6-12)8-4-2-3-5-9(8)11;/h2-5,7H,6,12H2,1H3,(H,13,14);1H
InChIKeyXMRSZCBJUAIGOQ-UHFFFAOYSA-N
MW249.14 g/mol
LogP1.90
Rot. Bonds3

About 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride

2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride (PubChem CID 119268984) has the molecular formula C10H14Cl2N2O and a molecular weight of 249.14 g/mol. Its IUPAC name is 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride
PubChem CID119268984
Molecular FormulaC10H14Cl2N2O
Molecular Weight249.14 g/mol
Exact Mass248.05
IUPAC Name2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride
SMILESCC(NC(=O)CN)c1ccccc1Cl.Cl
InChIInChI=1S/C10H13ClN2O.ClH/c1-7(13-10(14)6-12)8-4-2-3-5-9(8)11;/h2-5,7H,6,12H2,1H3,(H,13,14);1H
InChIKeyXMRSZCBJUAIGOQ-UHFFFAOYSA-N
XLogP1.90
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.14
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[(1S)-1-(2-chlorophenyl)ethyl]acetamide
CID 81378449
2-amino-N-[1-(2-chlorophenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119327061
N-[1-(2-chlorophenyl)ethyl]-2-(methylamino)acetamide
CID 60641198
N-[1-(2-chlorophenyl)ethyl]-3-methylbutanamide
CID 78773468
6-amino-N-[1-(2-chlorophenyl)ethyl]hexanamide
CID 51041452
(3S)-3-(aminomethyl)-N-[(1S)-1-(2-chlorophenyl)ethyl]-5-methylhexanamide
CID 81378546
2-[[2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl]amino]-N-methylacetamide
CID 8772390
N-[(1S)-1-(2-chlorophenyl)ethyl]-4-hydroxybutanamide
CID 81378925
3-amino-N-[(1R)-1-(2-chlorophenyl)ethyl]-3-phenylpropanamide
CID 81375536
2-amino-N-[(1R)-1-(2-chlorophenyl)ethyl]propanamide
CID 81378427
[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-phenoxyacetate
CID 7697704
N-[1-(2-chlorophenyl)ethyl]heptanamide
CID 57313827

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride (CID 119268984) is 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride is CC(NC(=O)CN)c1ccccc1Cl.Cl.
What is the InChIKey of 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride?
The InChIKey is XMRSZCBJUAIGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O.ClH/c1-7(13-10(14)6-12)8-4-2-3-5-9(8)11;/h2-5,7H,6,12H2,1H3,(H,13,14);1H.
What are the key properties of 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride?
2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride has a molecular weight of 249.14 g/mol, XLogP of 1.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119268984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).