N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide

C13H12FN3O — CID 43144626

IUPACN-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide
SMILESNc1ccc(NC(=O)Cc2ccc(F)cc2)nc1
InChIInChI=1S/C13H12FN3O/c14-10-3-1-9(2-4-10)7-13(18)17-12-6-5-11(15)8-16-12/h1-6,8H,7,15H2,(H,16,17,18)
InChIKeyBMQJSSVIVHFUKO-UHFFFAOYSA-N
MW245.26 g/mol
LogP1.98
Rot. Bonds3

About N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide

N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide (PubChem CID 43144626) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide
PubChem CID43144626
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC NameN-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide
SMILESNc1ccc(NC(=O)Cc2ccc(F)cc2)nc1
InChIInChI=1S/C13H12FN3O/c14-10-3-1-9(2-4-10)7-13(18)17-12-6-5-11(15)8-16-12/h1-6,8H,7,15H2,(H,16,17,18)
InChIKeyBMQJSSVIVHFUKO-UHFFFAOYSA-N
XLogP1.98
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-2-pyridinyl)-2-(2,5-difluorophenyl)acetamide
CID 115273710
2-(4-fluorophenyl)-N-[5-(propylamino)-2-pyridinyl]acetamide
CID 113023449
N-[5-[(4-chlorophenyl)methylamino]-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113027267
3-[6-[[2-(4-fluorophenyl)acetyl]amino]-3-pyridinyl]benzamide
CID 54591948
N-[6-(tert-butylamino)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113014791
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113032265
N-(5-amino-2-fluorophenyl)-2-(4-fluorophenyl)acetamide
CID 16789035
4-amino-2-[[2-(4-fluorophenyl)acetyl]amino]benzoic acid
CID 63116313
N-[6-(cyclohexylamino)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113010072
2-(4-fluorophenyl)-N-[6-(2-methylpropylamino)-3-pyridinyl]acetamide
CID 113009609
2-(4-bromophenyl)-N-(5-bromo-2-pyridinyl)acetamide
CID 29260244
2-(4-fluorophenyl)-N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]acetamide
CID 113027342

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide (CID 43144626) is N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide is Nc1ccc(NC(=O)Cc2ccc(F)cc2)nc1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide?
The InChIKey is BMQJSSVIVHFUKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O/c14-10-3-1-9(2-4-10)7-13(18)17-12-6-5-11(15)8-16-12/h1-6,8H,7,15H2,(H,16,17,18).
What are the key properties of N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide?
N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide has a molecular weight of 245.26 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 43144626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).