2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide

C20H22F2N2O2 — CID 169264915

IUPAC2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide
SMILESCC(C)(C(N)=O)c1cc(C(CO)C2CC2)nc(-c2ccc(F)cc2)c1F
InChIInChI=1S/C20H22F2N2O2/c1-20(2,19(23)26)15-9-16(14(10-25)11-3-4-11)24-18(17(15)22)12-5-7-13(21)8-6-12/h5-9,11,14,25H,3-4,10H2,1-2H3,(H2,23,26)
InChIKeyUIXZMLPSXVAXCL-UHFFFAOYSA-N
MW360.40 g/mol
LogP3.28
Rot. Bonds6

About 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide

2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide (PubChem CID 169264915) has the molecular formula C20H22F2N2O2 and a molecular weight of 360.40 g/mol. Its IUPAC name is 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide
PubChem CID169264915
Molecular FormulaC20H22F2N2O2
Molecular Weight360.40 g/mol
Exact Mass360.16
IUPAC Name2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide
SMILESCC(C)(C(N)=O)c1cc(C(CO)C2CC2)nc(-c2ccc(F)cc2)c1F
InChIInChI=1S/C20H22F2N2O2/c1-20(2,19(23)26)15-9-16(14(10-25)11-3-4-11)24-18(17(15)22)12-5-7-13(21)8-6-12/h5-9,11,14,25H,3-4,10H2,1-2H3,(H2,23,26)
InChIKeyUIXZMLPSXVAXCL-UHFFFAOYSA-N
XLogP3.28
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.40
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide 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

2-[6-(2-amino-1-cyclopropylethyl)-3-fluoro-2-(3-fluorophenyl)-4-pyridinyl]propan-2-ol
CID 156896004
ethane;[2-[5-fluoro-6-(4-fluorophenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-2-(2-methylcyclopropyl)ethoxy] thiohypoiodite
CID 169264678
4-amino-N-[2-cyclopropyl-2-[5-fluoro-6-(4-fluorophenyl)-4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2-pyridinyl]ethyl]-3-(cyclopropyliminomethyl)benzamide;methoxymethane
CID 169265034
2-[6-[(2S)-2-amino-2-(1-fluorocyclopropyl)-1-hydroxyethyl]-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-ol
CID 166792991
N-[2-[5-chloro-6-(4-fluorophenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-2-cyclopropylethyl]-2-fluoro-8-methoxy-3-methylquinoline-6-carboxamide
CID 166807792
2-(4-chloro-5-fluoro-6-methyl-2-pyridinyl)-2-cyclopropylethanol
CID 10799447
N-[2-cyclopropyl-2-[6-(4-fluorophenyl)-4-(1-methoxypropan-2-yl)-5-methyl-2-pyridinyl]ethyl]formamide
CID 169241090
2-cyclopropyl-2-(4-fluorophenyl)ethanol
CID 82075045
2-[6-(2-azido-1-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-ol
CID 170434009
2-[6-(2-amino-1-cyclopropyl-2,2-dideuterio-1-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-ol
CID 166519722
N-[2-cyclopropyl-2-[5-fluoro-4-(2-hydroxypropan-2-yl)-6-[4-(trifluoromethyl)phenyl]-2-pyridinyl]ethyl]-8-cyclopropyloxy-3-methylquinoline-6-carboxamide
CID 166807575
2-[6-[2-amino-2-(2-fluorocyclopropyl)-2-hydroxyethyl]-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]propan-2-ol
CID 166792977

Frequently Asked Questions

What is the IUPAC name of 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide?
The IUPAC name of 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide (CID 169264915) is 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide.
What is the SMILES notation for 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide?
The canonical SMILES for 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide is CC(C)(C(N)=O)c1cc(C(CO)C2CC2)nc(-c2ccc(F)cc2)c1F.
What is the InChIKey of 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide?
The InChIKey is UIXZMLPSXVAXCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22F2N2O2/c1-20(2,19(23)26)15-9-16(14(10-25)11-3-4-11)24-18(17(15)22)12-5-7-13(21)8-6-12/h5-9,11,14,25H,3-4,10H2,1-2H3,(H2,23,26).
What are the key properties of 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide?
2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide has a molecular weight of 360.40 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(1-cyclopropyl-2-hydroxyethyl)-3-fluoro-2-(4-fluorophenyl)-4-pyridinyl]-2-methylpropanamide is sourced from PubChem (CID 169264915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).