N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide

C15H16ClN3O — CID 43396868

IUPACN-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide
SMILESCC(NCC(=O)Nc1cccc(Cl)c1)c1ccccn1
InChIInChI=1S/C15H16ClN3O/c1-11(14-7-2-3-8-17-14)18-10-15(20)19-13-6-4-5-12(16)9-13/h2-9,11,18H,10H2,1H3,(H,19,20)
InChIKeyXGRZYNDBIHQUOQ-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.02
Rot. Bonds5

About N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide

N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide (PubChem CID 43396868) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide
PubChem CID43396868
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC NameN-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide
SMILESCC(NCC(=O)Nc1cccc(Cl)c1)c1ccccn1
InChIInChI=1S/C15H16ClN3O/c1-11(14-7-2-3-8-17-14)18-10-15(20)19-13-6-4-5-12(16)9-13/h2-9,11,18H,10H2,1H3,(H,19,20)
InChIKeyXGRZYNDBIHQUOQ-UHFFFAOYSA-N
XLogP3.02
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81407084
1-(3-chlorophenyl)-3-[(1R)-1-pyridin-2-ylethyl]urea
CID 41083408
N-(4-methylphenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406656
N-(2-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406571
N-(4-bromophenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401760
N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81393069
N-(2-methylphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401913
2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-N-phenylacetamide
CID 9330859
N-(3-chlorophenyl)-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]acetamide
CID 81347088
N-phenyl-3-(1-pyridin-2-ylethylamino)propanamide
CID 119106523
2-(but-3-yn-2-ylamino)-N-(3-chlorophenyl)acetamide
CID 114416777
N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406744

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide (CID 43396868) is N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide is CC(NCC(=O)Nc1cccc(Cl)c1)c1ccccn1.
What is the InChIKey of N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide?
The InChIKey is XGRZYNDBIHQUOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-11(14-7-2-3-8-17-14)18-10-15(20)19-13-6-4-5-12(16)9-13/h2-9,11,18H,10H2,1H3,(H,19,20).
What are the key properties of N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide?
N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide has a molecular weight of 289.77 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide is sourced from PubChem (CID 43396868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).