2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide

C11H16ClN3O — CID 133382755

IUPAC2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(CC)c1ncccc1Cl
InChIInChI=1S/C11H16ClN3O/c1-3-13-10(16)8-15(4-2)11-9(12)6-5-7-14-11/h5-7H,3-4,8H2,1-2H3,(H,13,16)
InChIKeyHVZQZOUSGMJSTA-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.70
Rot. Bonds5

About 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide

2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide (PubChem CID 133382755) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide
PubChem CID133382755
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(CC)c1ncccc1Cl
InChIInChI=1S/C11H16ClN3O/c1-3-13-10(16)8-15(4-2)11-9(12)6-5-7-14-11/h5-7H,3-4,8H2,1-2H3,(H,13,16)
InChIKeyHVZQZOUSGMJSTA-UHFFFAOYSA-N
XLogP1.70
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,5-dichloropyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 79633316
2-[(2-chloro-5-methylpyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 79072774
N-ethyl-2-[ethyl-(3-methylquinoxalin-2-yl)amino]acetamide
CID 133382747
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-hydroxypyridine-2-carboxamide
CID 54986422
N-ethyl-2-[[3-(1-hydroxyethyl)-2-pyridinyl]-methylamino]acetamide
CID 114055927
N,N-dibutyl-3-chloropyridin-2-amine
CID 135025261
2-[(5-amino-7-fluoroquinolin-8-yl)-ethylamino]-N-ethylacetamide
CID 83165492
ethyl 2-[(3-chloro-2-pyridinyl)-methylamino]acetate
CID 62006591
N-benzoyl-N-(3-chloro-2-pyridinyl)benzamide
CID 165355882
methyl 3-[(3-chloro-2-pyridinyl)-(2-methoxyethyl)amino]propanoate
CID 113331207
N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide
CID 104839933
2-[(6-amino-5-ethylpyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 80805333

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide?
The IUPAC name of 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide (CID 133382755) is 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide.
What is the SMILES notation for 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide?
The canonical SMILES for 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide is CCNC(=O)CN(CC)c1ncccc1Cl.
What is the InChIKey of 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide?
The InChIKey is HVZQZOUSGMJSTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-3-13-10(16)8-15(4-2)11-9(12)6-5-7-14-11/h5-7H,3-4,8H2,1-2H3,(H,13,16).
What are the key properties of 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide?
2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide has a molecular weight of 241.72 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide is sourced from PubChem (CID 133382755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).