2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide

C11H16FN3O — CID 62733234

IUPAC2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1ncccc1F
InChIInChI=1S/C11H16FN3O/c1-3-6-14-11(16)8(2)15-10-9(12)5-4-7-13-10/h4-5,7-8H,3,6H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyAMZBDQHBKFXTPQ-UHFFFAOYSA-N
MW225.27 g/mol
LogP1.55
Rot. Bonds5

About 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide

2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide (PubChem CID 62733234) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide
PubChem CID62733234
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)Nc1ncccc1F
InChIInChI=1S/C11H16FN3O/c1-3-6-14-11(16)8(2)15-10-9(12)5-4-7-13-10/h4-5,7-8H,3,6H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyAMZBDQHBKFXTPQ-UHFFFAOYSA-N
XLogP1.55
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-methylsulfonyl-2-pyridinyl)amino]-N-propylpropanamide
CID 114598760
2-[(3-carbamothioyl-2-pyridinyl)amino]-N-propylpropanamide
CID 54958501
2-[(3-carbamothioylpyrazin-2-yl)amino]-N-propylpropanamide
CID 62683434
3-fluoro-N-propan-2-ylpyridin-2-amine
CID 62733783
2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 112551724
2-[(3-fluoro-2-pyridinyl)amino]-1-piperidin-1-ylpropan-1-one
CID 112551708
2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]-N-propylpropanamide
CID 62151211
2-(4-fluoroanilino)-N-propylpropanamide
CID 43086796
2-[(3-chloro-2-pyridinyl)amino]-N-(2-methoxyethyl)propanamide
CID 113407922
ethyl 2-[[1-(ethylamino)-1-oxopropan-2-yl]amino]pyridine-3-carboxylate
CID 61480191
N-(3-fluoro-2-pyridinyl)propanamide
CID 130249129
2-(2-methylsulfanylanilino)-N-propylpropanamide
CID 113219250

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide?
The IUPAC name of 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide (CID 62733234) is 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide.
What is the SMILES notation for 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide?
The canonical SMILES for 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide is CCCNC(=O)C(C)Nc1ncccc1F.
What is the InChIKey of 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide?
The InChIKey is AMZBDQHBKFXTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c1-3-6-14-11(16)8(2)15-10-9(12)5-4-7-13-10/h4-5,7-8H,3,6H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide?
2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide has a molecular weight of 225.27 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-2-pyridinyl)amino]-N-propylpropanamide is sourced from PubChem (CID 62733234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).