N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine

C19H20F4N2O — CID 156718291

IUPACN-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine
SMILESC=CNCC(c1cc(C)c(OCC)c(-c2ccc(F)cc2)n1)C(F)(F)F
InChIInChI=1S/C19H20F4N2O/c1-4-24-11-15(19(21,22)23)16-10-12(3)18(26-5-2)17(25-16)13-6-8-14(20)9-7-13/h4,6-10,15,24H,1,5,11H2,2-3H3
InChIKeyOMEFSJQEKPWMNO-UHFFFAOYSA-N
MW368.37 g/mol
LogP4.97
Rot. Bonds7

About N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine

N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine (PubChem CID 156718291) has the molecular formula C19H20F4N2O and a molecular weight of 368.37 g/mol. Its IUPAC name is N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine.

Molecular Properties

Compound NameN-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine
PubChem CID156718291
Molecular FormulaC19H20F4N2O
Molecular Weight368.37 g/mol
Exact Mass368.15
IUPAC NameN-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine
SMILESC=CNCC(c1cc(C)c(OCC)c(-c2ccc(F)cc2)n1)C(F)(F)F
InChIInChI=1S/C19H20F4N2O/c1-4-24-11-15(19(21,22)23)16-10-12(3)18(26-5-2)17(25-16)13-6-8-14(20)9-7-13/h4,6-10,15,24H,1,5,11H2,2-3H3
InChIKeyOMEFSJQEKPWMNO-UHFFFAOYSA-N
XLogP4.97
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.37
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine with MolForge

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Related Compounds

2-[4-butan-2-yl-6-(4-fluorophenyl)-5-methyl-2-pyridinyl]-3,3,3-trifluoro-N-methylpropan-1-amine
CID 165395634
N-[3,3,3-trifluoro-2-[3-(fluoromethyl)-7-(4-fluorophenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]propyl]formamide
CID 156872756
ethane;N-(4-ethenyl-2-methylphenyl)propan-1-imine;2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-N-methylethanamine;formamide
CID 156718127
N-[2-[3,3-bis(fluoromethyl)-7-(4-fluorophenyl)-2H-furo[2,3-c]pyridin-5-yl]-3,3,3-trifluoropropyl]-8-methoxy-3-methylquinoline-6-carboxamide
CID 156872961
N-[2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]ethyl]-1-(methylamino)isoquinoline-6-carboxamide;formamide;methane
CID 165395665
CID 164910544
CID 164910544
2-[(Z)-2-aminoprop-1-enyl]-6-cyclopropyloxy-4-methylaniline;fluoromethane;N-[3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]formamide
CID 156872491
[6-chloro-2-(4-fluorophenyl)-4-methyl-3-pyridinyl]oxy thiohypofluorite
CID 156872496
(3S)-3-(fluoromethyl)-7-(4-fluorophenyl)-5-[1,1,1-trifluoro-3-[(8-methoxy-3-methylquinoline-6-carbonyl)amino]propan-2-yl]-2H-furo[2,3-c]pyridine-3-carboxamide
CID 164911200
3-fluoro-8-methoxy-2-methyl-N-[3,3,3-trifluoro-2-[7-(4-fluorophenyl)-3-methyl-2,3-dihydrofuro[2,3-c]pyridin-5-yl]propyl]quinoline-6-carboxamide;formamide
CID 156872800
N-[2-cyclopropyl-2-[6-(4-fluorophenyl)-4-(1-methoxypropan-2-yl)-5-methyl-2-pyridinyl]ethyl]formamide
CID 169241090
4-cyclopropyloxy-3-methoxy-N-[3,3,3-trifluoro-2-[6-(4-fluorophenyl)-4-methyl-2-pyridinyl]propyl]benzamide
CID 123769132

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine?
The IUPAC name of N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine (CID 156718291) is N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine.
What is the SMILES notation for N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine?
The canonical SMILES for N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine is C=CNCC(c1cc(C)c(OCC)c(-c2ccc(F)cc2)n1)C(F)(F)F.
What is the InChIKey of N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine?
The InChIKey is OMEFSJQEKPWMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F4N2O/c1-4-24-11-15(19(21,22)23)16-10-12(3)18(26-5-2)17(25-16)13-6-8-14(20)9-7-13/h4,6-10,15,24H,1,5,11H2,2-3H3.
What are the key properties of N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine?
N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine has a molecular weight of 368.37 g/mol, XLogP of 4.97, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-[5-ethoxy-6-(4-fluorophenyl)-4-methyl-2-pyridinyl]-3,3,3-trifluoropropan-1-amine is sourced from PubChem (CID 156718291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).