2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one

C144H111F15N30O6 — CID 158132214

IUPAC2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
SMILESCC#Cc1cncc(-c2cccc(C3(c4ccc(C(F)(F)F)cn4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4ccc(C(F)F)cn4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cccc(C(F)(F)F)n4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cccc(C(F)F)n4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cncc(C(F)(F)F)c4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cncc(C(F)F)c4)N=C(N)N(C)C3=O)c2)c1
InChIInChI=1S/3C24H18F3N5O.3C24H19F2N5O/c1-3-6-15-11-17(14-29-13-15)16-7-4-8-18(12-16)23(21(33)32(2)22(28)31-23)19-9-5-10-20(30-19)24(25,26)27;1-3-5-15-8-17(12-29-11-15)16-6-4-7-18(9-16)23(21(33)32(2)22(28)31-23)19-10-20(14-30-13-19)24(25,26)27;1-3-5-15-10-17(13-29-12-15)16-6-4-7-18(11-16)23(21(33)32(2)22(28)31-23)20-9-8-19(14-30-20)24(25,26)27;1-3-6-15-11-17(14-28-13-15)16-7-4-8-18(12-16)24(22(32)31(2)23(27)30-24)20-10-5-9-19(29-20)21(25)26;1-3-5-15-8-17(12-28-11-15)16-6-4-7-19(9-16)24(22(32)31(2)23(27)30-24)20-10-18(21(25)26)13-29-14-20;1-3-5-15-10-18(13-28-12-15)16-6-4-7-19(11-16)24(22(32)31(2)23(27)30-24)20-9-8-17(14-29-20)21(25)26/h4-5,7-14H,1-2H3,(H2,28,31);2*4,6-14H,1-2H3,(H2,28,31);4-5,7-14,21H,1-2H3,(H2,27,30);2*4,6-14,21H,1-2H3,(H2,27,30)
InChIKeyFSXMDGHBYBYDFU-UHFFFAOYSA-N
MW2642.65 g/mol
LogP21.14
Rot. Bonds21

About 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one

2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one (PubChem CID 158132214) has the molecular formula C144H111F15N30O6 and a molecular weight of 2642.65 g/mol. Its IUPAC name is 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one.

Molecular Properties

Compound Name2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
PubChem CID158132214
Molecular FormulaC144H111F15N30O6
Molecular Weight2642.65 g/mol
Exact Mass2640.91
IUPAC Name2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
SMILESCC#Cc1cncc(-c2cccc(C3(c4ccc(C(F)(F)F)cn4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4ccc(C(F)F)cn4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cccc(C(F)(F)F)n4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cccc(C(F)F)n4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cncc(C(F)(F)F)c4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cncc(C(F)F)c4)N=C(N)N(C)C3=O)c2)c1
InChIInChI=1S/3C24H18F3N5O.3C24H19F2N5O/c1-3-6-15-11-17(14-29-13-15)16-7-4-8-18(12-16)23(21(33)32(2)22(28)31-23)19-9-5-10-20(30-19)24(25,26)27;1-3-5-15-8-17(12-29-11-15)16-6-4-7-18(9-16)23(21(33)32(2)22(28)31-23)19-10-20(14-30-13-19)24(25,26)27;1-3-5-15-10-17(13-29-12-15)16-6-4-7-18(11-16)23(21(33)32(2)22(28)31-23)20-9-8-19(14-30-20)24(25,26)27;1-3-6-15-11-17(14-28-13-15)16-7-4-8-18(12-16)24(22(32)31(2)23(27)30-24)20-10-5-9-19(29-20)21(25)26;1-3-5-15-8-17(12-28-11-15)16-6-4-7-19(9-16)24(22(32)31(2)23(27)30-24)20-10-18(21(25)26)13-29-14-20;1-3-5-15-10-18(13-28-12-15)16-6-4-7-19(11-16)24(22(32)31(2)23(27)30-24)20-9-8-17(14-29-20)21(25)26/h4-5,7-14H,1-2H3,(H2,28,31);2*4,6-14H,1-2H3,(H2,28,31);4-5,7-14,21H,1-2H3,(H2,27,30);2*4,6-14,21H,1-2H3,(H2,27,30)
InChIKeyFSXMDGHBYBYDFU-UHFFFAOYSA-N
XLogP21.14
TPSA506.82 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds21
Heavy Atoms195
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002642.65
LogP ≤ 521.14
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one 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-Amino-3-[[3-[2-amino-4-[6-(difluoromethyl)-2-pyridinyl]-1-methyl-5-oxoimidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-5-[3-(difluoromethyl)phenyl]-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 137394398
2-Amino-3-[[3-[2-amino-1-[[3-[2-amino-4-[6-(difluoromethyl)-2-pyridinyl]-1-methyl-5-oxoimidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-4-[3-(difluoromethyl)phenyl]-5-oxoimidazol-4-yl]-5-pyrimidin-5-ylphenyl]methyl]-5-[6-(fluoromethyl)-3-pyridinyl]-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 142510293
2-Amino-3-methyl-5-[3-(5-prop-1-ynylpyridin-3-yl)phenyl]-5-[5-(trifluoromethyl)pyridin-2-yl]imidazol-4-one
CID 146622520
2-Amino-3-[2-[5-[2-amino-1-methyl-5-oxo-4-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-yl]-3-pyridinyl]-2-fluoroethyl]-5-[6-(fluoromethyl)-2-pyridinyl]-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one
CID 146622747
2-Amino-5-[2-[2-[2-amino-4-[4-[2-[2-amino-4-(6-ethyl-3-pyridinyl)-5-oxo-4-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-1-yl]-1-fluoroethyl]-2-pyridinyl]-5-oxo-4-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-1-yl]-1-fluoroethyl]-4-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one
CID 146623003
2-Amino-5-[6-(difluoromethyl)pyridin-3-yl]-3-methyl-5-[3-(5-prop-1-ynylpyridin-3-yl)phenyl]imidazol-4-one
CID 146623005
2-Amino-5-[4-(difluoromethyl)pyridin-2-yl]-3-methyl-5-[3-(5-prop-1-ynylpyridin-3-yl)phenyl]imidazol-4-one
CID 146807189
2-Amino-5-[5-(difluoromethyl)pyridin-2-yl]-3-methyl-5-[3-(5-prop-1-ynylpyridin-3-yl)phenyl]imidazol-4-one
CID 153223144
2-Amino-5-[3-[1-[2-[2-amino-1-methyl-5-oxo-4-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-yl]propyl]-5-fluoropyridin-1-ium-3-yl]phenyl]-3-methyl-5-propan-2-ylimidazol-4-one
CID 153339157
2-Amino-5-[6-(fluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one
CID 153495971
2-Amino-5-[4-(fluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one
CID 153495979
2-Amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one
CID 153495987

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
The IUPAC name of 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one (CID 158132214) is 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one.
What is the SMILES notation for 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
The canonical SMILES for 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one is CC#Cc1cncc(-c2cccc(C3(c4ccc(C(F)(F)F)cn4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4ccc(C(F)F)cn4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cccc(C(F)(F)F)n4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cccc(C(F)F)n4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cncc(C(F)(F)F)c4)N=C(N)N(C)C3=O)c2)c1.CC#Cc1cncc(-c2cccc(C3(c4cncc(C(F)F)c4)N=C(N)N(C)C3=O)c2)c1.
What is the InChIKey of 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
The InChIKey is FSXMDGHBYBYDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C24H18F3N5O.3C24H19F2N5O/c1-3-6-15-11-17(14-29-13-15)16-7-4-8-18(12-16)23(21(33)32(2)22(28)31-23)19-9-5-10-20(30-19)24(25,26)27;1-3-5-15-8-17(12-29-11-15)16-6-4-7-18(9-16)23(21(33)32(2)22(28)31-23)19-10-20(14-30-13-19)24(25,26)27;1-3-5-15-10-17(13-29-12-15)16-6-4-7-18(11-16)23(21(33)32(2)22(28)31-23)20-9-8-19(14-30-20)24(25,26)27;1-3-6-15-11-17(14-28-13-15)16-7-4-8-18(12-16)24(22(32)31(2)23(27)30-24)20-10-5-9-19(29-20)21(25)26;1-3-5-15-8-17(12-28-11-15)16-6-4-7-19(9-16)24(22(32)31(2)23(27)30-24)20-10-18(21(25)26)13-29-14-20;1-3-5-15-10-18(13-28-12-15)16-6-4-7-19(11-16)24(22(32)31(2)23(27)30-24)20-9-8-17(14-29-20)21(25)26/h4-5,7-14H,1-2H3,(H2,28,31);2*4,6-14H,1-2H3,(H2,28,31);4-5,7-14,21H,1-2H3,(H2,27,30);2*4,6-14,21H,1-2H3,(H2,27,30).
What are the key properties of 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one?
2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one has a molecular weight of 2642.65 g/mol, XLogP of 21.14, 21 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[5-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[5-(difluoromethyl)-3-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-5-[6-(difluoromethyl)-2-pyridinyl]-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-3-methyl-5-[3-(5-prop-1-ynyl-3-pyridinyl)phenyl]-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one is sourced from PubChem (CID 158132214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).