5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide

C15H16FN3O — CID 61117008

IUPAC5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)NC(C)c1ccccc1F
InChIInChI=1S/C15H16FN3O/c1-9-13(7-11(17)8-18-9)15(20)19-10(2)12-5-3-4-6-14(12)16/h3-8,10H,17H2,1-2H3,(H,19,20)
InChIKeyLPCUHSUNSVFTHO-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.60
Rot. Bonds3

About 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide

5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide (PubChem CID 61117008) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide
PubChem CID61117008
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC Name5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)NC(C)c1ccccc1F
InChIInChI=1S/C15H16FN3O/c1-9-13(7-11(17)8-18-9)15(20)19-10(2)12-5-3-4-6-14(12)16/h3-8,10H,17H2,1-2H3,(H,19,20)
InChIKeyLPCUHSUNSVFTHO-UHFFFAOYSA-N
XLogP2.60
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-2-methyl-N-[1-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 61118673
5-amino-2-methyl-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide
CID 93467775
5-amino-2,4-difluoro-N-[1-(2-fluorophenyl)ethyl]benzamide
CID 61117350
5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 61039486
3-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylbenzamide
CID 61118167
5-amino-N-[1-(4-ethylphenyl)ethyl]-2-methylpyridine-3-carboxamide
CID 61139068
2,3-difluoro-N-[1-(2-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 105380534
5-amino-2-methyl-N-pentan-2-ylpyridine-3-carboxamide
CID 61040311
5-amino-2-methyl-N-(2-methylsulfanylphenyl)pyridine-3-carboxamide
CID 61117272
methyl 2-[(5-amino-2-methylpyridine-3-carbonyl)amino]-3-methylbutanoate
CID 54917349
2-N-[1-(2-fluorophenyl)ethyl]-3-methylpyridine-2,5-diamine
CID 55080459
N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide
CID 62508680

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide?
The IUPAC name of 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide (CID 61117008) is 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide?
The canonical SMILES for 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)NC(C)c1ccccc1F.
What is the InChIKey of 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide?
The InChIKey is LPCUHSUNSVFTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c1-9-13(7-11(17)8-18-9)15(20)19-10(2)12-5-3-4-6-14(12)16/h3-8,10H,17H2,1-2H3,(H,19,20).
What are the key properties of 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide?
5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide has a molecular weight of 273.31 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 61117008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).