2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide

C11H17ClN4O — CID 103106676

IUPAC2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1ncc(Cl)cc1N
InChIInChI=1S/C11H17ClN4O/c1-4-16(3)11(17)7(2)15-10-9(13)5-8(12)6-14-10/h5-7H,4,13H2,1-3H3,(H,14,15)
InChIKeyGCAJIPJFHSTMTK-UHFFFAOYSA-N
MW256.74 g/mol
LogP1.60
Rot. Bonds4

About 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide

2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide (PubChem CID 103106676) has the molecular formula C11H17ClN4O and a molecular weight of 256.74 g/mol. Its IUPAC name is 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
PubChem CID103106676
Molecular FormulaC11H17ClN4O
Molecular Weight256.74 g/mol
Exact Mass256.11
IUPAC Name2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1ncc(Cl)cc1N
InChIInChI=1S/C11H17ClN4O/c1-4-16(3)11(17)7(2)15-10-9(13)5-8(12)6-14-10/h5-7H,4,13H2,1-3H3,(H,14,15)
InChIKeyGCAJIPJFHSTMTK-UHFFFAOYSA-N
XLogP1.60
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-6-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]pyridine-3-carboxylic acid
CID 103113348
2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
CID 103114114
2-[[5-chloro-2-(methylamino)pyrimidin-4-yl]amino]-N-ethyl-N-methylpropanamide
CID 103113988
2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106716
2-(4,6-diamino-3-chloro-2-fluoroanilino)-N-ethyl-N-methylpropanamide
CID 103553561
2-[(2-chloro-4-pyridinyl)amino]-N-ethyl-N-methylpropanamide
CID 103112969
2-[(3-amino-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365954
2-[(2-aminoquinazolin-4-yl)amino]-N-ethyl-N-methylpropanamide
CID 103114058
5-chloro-2-N-pent-4-yn-2-ylpyridine-2,3-diamine
CID 130535478
N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide
CID 103114097
2-[(6-chloroquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide
CID 154839535
ethyl 2-[(3-bromo-5-chloro-2-pyridinyl)amino]propanoate
CID 114835797

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide (CID 103106676) is 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)Nc1ncc(Cl)cc1N.
What is the InChIKey of 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide?
The InChIKey is GCAJIPJFHSTMTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN4O/c1-4-16(3)11(17)7(2)15-10-9(13)5-8(12)6-14-10/h5-7H,4,13H2,1-3H3,(H,14,15).
What are the key properties of 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide?
2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide has a molecular weight of 256.74 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103106676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).