2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide

C17H19FN2O2 — CID 110306923

IUPAC2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide
SMILESC[C@@H](CO)NC(=O)C(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C17H19FN2O2/c1-12(11-21)20-17(22)16(9-13-3-2-8-19-10-13)14-4-6-15(18)7-5-14/h2-8,10,12,16,21H,9,11H2,1H3,(H,20,22)/t12-,16?/m0/s1
InChIKeyVNIKYJQBOSDDDO-HKALDPMFSA-N
MW302.35 g/mol
LogP2.04
Rot. Bonds6

About 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide

2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide (PubChem CID 110306923) has the molecular formula C17H19FN2O2 and a molecular weight of 302.35 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide
PubChem CID110306923
Molecular FormulaC17H19FN2O2
Molecular Weight302.35 g/mol
Exact Mass302.14
IUPAC Name2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide
SMILESC[C@@H](CO)NC(=O)C(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C17H19FN2O2/c1-12(11-21)20-17(22)16(9-13-3-2-8-19-10-13)14-4-6-15(18)7-5-14/h2-8,10,12,16,21H,9,11H2,1H3,(H,20,22)/t12-,16?/m0/s1
InChIKeyVNIKYJQBOSDDDO-HKALDPMFSA-N
XLogP2.04
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dichlorophenyl)-2-(4-fluorophenyl)-3-pyridin-3-ylpropanamide
CID 110296516
N-[(4-fluorophenyl)methyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110409718
2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
CID 110296524
N-(1-hydroxypropan-2-yl)-2-pyridin-3-ylacetamide
CID 62691061
2-(4-fluorophenyl)-1-(4-methylpiperazin-1-yl)-3-pyridin-3-ylpropan-1-one
CID 110296415
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-fluorophenyl)-3-pyridin-3-ylpropanamide
CID 110296450
2-(4-fluorophenyl)-3-pyridin-3-yl-N-[2-(1,3-thiazol-4-yl)ethyl]propanamide
CID 110305024
N-benzyl-N-ethyl-2-(4-fluorophenyl)-3-pyridin-3-ylpropanamide
CID 110296433
2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide
CID 110296494
2-(4-fluorophenyl)-1-morpholin-4-yl-3-pyridin-3-ylpropan-1-one
CID 110296410
2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide
CID 110296305
N-(3-fluorophenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425726

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide (CID 110306923) is 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide is C[C@@H](CO)NC(=O)C(Cc1cccnc1)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide?
The InChIKey is VNIKYJQBOSDDDO-HKALDPMFSA-N. The full InChI is InChI=1S/C17H19FN2O2/c1-12(11-21)20-17(22)16(9-13-3-2-8-19-10-13)14-4-6-15(18)7-5-14/h2-8,10,12,16,21H,9,11H2,1H3,(H,20,22)/t12-,16?/m0/s1.
What are the key properties of 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide?
2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide has a molecular weight of 302.35 g/mol, XLogP of 2.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 110306923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).