2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide

C22H21FN2O2 — CID 110296494

IUPAC2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide
SMILESCOc1ccc(C)cc1NC(=O)C(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C22H21FN2O2/c1-15-5-10-21(27-2)20(12-15)25-22(26)19(13-16-4-3-11-24-14-16)17-6-8-18(23)9-7-17/h3-12,14,19H,13H2,1-2H3,(H,25,26)
InChIKeyAENJCBPBYCATDQ-UHFFFAOYSA-N
MW364.42 g/mol
LogP4.50
Rot. Bonds6

About 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide

2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide (PubChem CID 110296494) has the molecular formula C22H21FN2O2 and a molecular weight of 364.42 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide
PubChem CID110296494
Molecular FormulaC22H21FN2O2
Molecular Weight364.42 g/mol
Exact Mass364.16
IUPAC Name2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide
SMILESCOc1ccc(C)cc1NC(=O)C(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C22H21FN2O2/c1-15-5-10-21(27-2)20(12-15)25-22(26)19(13-16-4-3-11-24-14-16)17-6-8-18(23)9-7-17/h3-12,14,19H,13H2,1-2H3,(H,25,26)
InChIKeyAENJCBPBYCATDQ-UHFFFAOYSA-N
XLogP4.50
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110422839
2-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)-3-pyridin-3-ylpropanamide
CID 110296795
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-fluorophenyl)-3-pyridin-3-ylpropanamide
CID 110296450
1-(2-methoxy-5-methylphenyl)-3-(pyridin-3-ylmethyl)urea
CID 3797502
2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
CID 110296524
N-(2,6-dichlorophenyl)-2-(4-fluorophenyl)-3-pyridin-3-ylpropanamide
CID 110296516
2-(4-fluorophenyl)-N-[(2S)-1-hydroxypropan-2-yl]-3-pyridin-3-ylpropanamide
CID 110306923
1-N'-(2-methoxy-5-methylphenyl)-1-N-(pyridin-3-ylmethyl)cyclopropane-1,1-dicarboxamide
CID 108976865
N-(2-methoxy-5-methylphenyl)-2-[4-(pyridin-3-ylmethoxy)phenoxy]acetamide
CID 60525115
(2S)-2-[(4-fluorophenyl)sulfonylamino]-N-(2-methoxy-5-methylphenyl)-3-phenylpropanamide
CID 28541028
N-(3-fluorophenyl)-2-phenyl-3-pyridin-3-ylpropanamide
CID 110425726
1-[2-(dimethylamino)ethyl]-3-(2-methoxy-5-methylphenyl)-1-(pyridin-3-ylmethyl)urea
CID 87009032

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide (CID 110296494) is 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide is COc1ccc(C)cc1NC(=O)C(Cc1cccnc1)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide?
The InChIKey is AENJCBPBYCATDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FN2O2/c1-15-5-10-21(27-2)20(12-15)25-22(26)19(13-16-4-3-11-24-14-16)17-6-8-18(23)9-7-17/h3-12,14,19H,13H2,1-2H3,(H,25,26).
What are the key properties of 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide?
2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide has a molecular weight of 364.42 g/mol, XLogP of 4.50, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(2-methoxy-5-methylphenyl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 110296494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).