N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide

C15H16ClN3O — CID 28579213

IUPACN-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide
SMILESO=C(CNCCc1ccccn1)Nc1ccccc1Cl
InChIInChI=1S/C15H16ClN3O/c16-13-6-1-2-7-14(13)19-15(20)11-17-10-8-12-5-3-4-9-18-12/h1-7,9,17H,8,10-11H2,(H,19,20)
InChIKeyQJDKFRKOQBBSQW-UHFFFAOYSA-N
MW289.77 g/mol
LogP2.51
Rot. Bonds6

About N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide

N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide (PubChem CID 28579213) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide
PubChem CID28579213
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC NameN-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide
SMILESO=C(CNCCc1ccccn1)Nc1ccccc1Cl
InChIInChI=1S/C15H16ClN3O/c16-13-6-1-2-7-14(13)19-15(20)11-17-10-8-12-5-3-4-9-18-12/h1-7,9,17H,8,10-11H2,(H,19,20)
InChIKeyQJDKFRKOQBBSQW-UHFFFAOYSA-N
XLogP2.51
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 52.51
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

N-(2-chlorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895695
2-[(2-chlorophenyl)carbamothioylamino]-N-(2-pyridin-2-ylethyl)benzamide
CID 134116682
N-(2-chlorophenyl)-3-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propanamide
CID 30138028
N-(2-chlorophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 60660334
N-(2-chlorophenyl)-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 109002569
N-(2-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406571
N-(2-chlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide
CID 62640663
N-(2-chlorophenyl)-2-(prop-2-enylamino)acetamide
CID 28563439
tert-butyl 2-(2-pyridin-2-ylethylamino)acetate
CID 60680814
N-(3-chloro-4-methylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 108999138
3-(2-pyridin-2-ylethylamino)propanoic acid
CID 28830364
N-(2-chlorophenyl)-2-[[1-(hydroxymethyl)cyclopropyl]methylamino]acetamide
CID 113313241

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide (CID 28579213) is N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide is O=C(CNCCc1ccccn1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide?
The InChIKey is QJDKFRKOQBBSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c16-13-6-1-2-7-14(13)19-15(20)11-17-10-8-12-5-3-4-9-18-12/h1-7,9,17H,8,10-11H2,(H,19,20).
What are the key properties of N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide?
N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide has a molecular weight of 289.77 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(2-pyridin-2-ylethylamino)acetamide is sourced from PubChem (CID 28579213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).