N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide

C20H23FN2O2 — CID 95968149

IUPACN-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide
SMILESC[C@@H]1CC[C@H](CCC(=O)N(Cc2cccnc2)c2ccc(F)cc2)O1
InChIInChI=1S/C20H23FN2O2/c1-15-4-9-19(25-15)10-11-20(24)23(14-16-3-2-12-22-13-16)18-7-5-17(21)6-8-18/h2-3,5-8,12-13,15,19H,4,9-11,14H2,1H3/t15-,19-/m1/s1
InChIKeyPPIBSAVCEJRTAV-DNVCBOLYSA-N
MW342.41 g/mol
LogP4.10
Rot. Bonds6

About N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide

N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 95968149) has the molecular formula C20H23FN2O2 and a molecular weight of 342.41 g/mol. Its IUPAC name is N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide
PubChem CID95968149
Molecular FormulaC20H23FN2O2
Molecular Weight342.41 g/mol
Exact Mass342.17
IUPAC NameN-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide
SMILESC[C@@H]1CC[C@H](CCC(=O)N(Cc2cccnc2)c2ccc(F)cc2)O1
InChIInChI=1S/C20H23FN2O2/c1-15-4-9-19(25-15)10-11-20(24)23(14-16-3-2-12-22-13-16)18-7-5-17(21)6-8-18/h2-3,5-8,12-13,15,19H,4,9-11,14H2,1H3/t15-,19-/m1/s1
InChIKeyPPIBSAVCEJRTAV-DNVCBOLYSA-N
XLogP4.10
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.41
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)-3-thiophen-2-ylpropanamide
CID 110360844
N-(4-fluorophenyl)-2-[[(2R)-oxolan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide
CID 95625827
N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
CID 75416170
N-(4-fluorophenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 13304879
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 110360828
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360820
3-amino-N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 39368333
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrrolidine-1-carboxamide
CID 71938987
N-benzyl-N-(2-hydroxyethyl)-3-(5-methyloxolan-2-yl)propanamide
CID 111477088
N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 110360399
N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
N-phenyl-4-pyridin-3-yl-N-(pyridin-3-ylmethyl)butanamide
CID 110613065

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide (CID 95968149) is N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide is C[C@@H]1CC[C@H](CCC(=O)N(Cc2cccnc2)c2ccc(F)cc2)O1.
What is the InChIKey of N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is PPIBSAVCEJRTAV-DNVCBOLYSA-N. The full InChI is InChI=1S/C20H23FN2O2/c1-15-4-9-19(25-15)10-11-20(24)23(14-16-3-2-12-22-13-16)18-7-5-17(21)6-8-18/h2-3,5-8,12-13,15,19H,4,9-11,14H2,1H3/t15-,19-/m1/s1.
What are the key properties of N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide?
N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 342.41 g/mol, XLogP of 4.10, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-3-[(2R,5R)-5-methyloxolan-2-yl]-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 95968149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).