N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine

C99H83F3N10O — CID 158316818

IUPACN-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine
SMILESC(=N/C(c1ccccc1)c1ccc2ccccc2c1)\c1ccccn1.C(=N/C(c1ccccc1)c1cccc2ccccc12)\c1ccccn1.C(=N/C(c1ccccc1)c1ccco1)\c1ccccn1.Cc1cc(C(/N=C/c2ccccn2)c2ccccc2)cc(C(F)(F)F)c1.Cc1ccccc1[C@H](C)/N=C/c1ccccn1
InChIInChI=1S/2C23H18N2.C21H17F3N2.C17H14N2O.C15H16N2/c1-2-10-19(11-3-1)23(25-17-20-13-6-7-16-24-20)22-15-8-12-18-9-4-5-14-21(18)22;1-2-9-19(10-3-1)23(25-17-22-12-6-7-15-24-22)21-14-13-18-8-4-5-11-20(18)16-21;1-15-11-17(13-18(12-15)21(22,23)24)20(16-7-3-2-4-8-16)26-14-19-9-5-6-10-25-19;1-2-7-14(8-3-1)17(16-10-6-12-20-16)19-13-15-9-4-5-11-18-15;1-12-7-3-4-9-15(12)13(2)17-11-14-8-5-6-10-16-14/h2*1-17,23H;2-14,20H,1H3;1-13,17H;3-11,13H,1-2H3/b2*25-17+;26-14+;19-13+;17-11+/t;;;;13-/m....0/s1
InChIKeyGOIZCXCPWWTZOR-WZNPJVJYSA-N
MW1485.82 g/mol
LogP23.96
Rot. Bonds19

About N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine

N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine (PubChem CID 158316818) has the molecular formula C99H83F3N10O and a molecular weight of 1485.82 g/mol. Its IUPAC name is N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine
PubChem CID158316818
Molecular FormulaC99H83F3N10O
Molecular Weight1485.82 g/mol
Exact Mass1484.67
IUPAC NameN-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine
SMILESC(=N/C(c1ccccc1)c1ccc2ccccc2c1)\c1ccccn1.C(=N/C(c1ccccc1)c1cccc2ccccc12)\c1ccccn1.C(=N/C(c1ccccc1)c1ccco1)\c1ccccn1.Cc1cc(C(/N=C/c2ccccn2)c2ccccc2)cc(C(F)(F)F)c1.Cc1ccccc1[C@H](C)/N=C/c1ccccn1
InChIInChI=1S/2C23H18N2.C21H17F3N2.C17H14N2O.C15H16N2/c1-2-10-19(11-3-1)23(25-17-20-13-6-7-16-24-20)22-15-8-12-18-9-4-5-14-21(18)22;1-2-9-19(10-3-1)23(25-17-22-12-6-7-15-24-22)21-14-13-18-8-4-5-11-20(18)16-21;1-15-11-17(13-18(12-15)21(22,23)24)20(16-7-3-2-4-8-16)26-14-19-9-5-6-10-25-19;1-2-7-14(8-3-1)17(16-10-6-12-20-16)19-13-15-9-4-5-11-18-15;1-12-7-3-4-9-15(12)13(2)17-11-14-8-5-6-10-16-14/h2*1-17,23H;2-14,20H,1H3;1-13,17H;3-11,13H,1-2H3/b2*25-17+;26-14+;19-13+;17-11+/t;;;;13-/m....0/s1
InChIKeyGOIZCXCPWWTZOR-WZNPJVJYSA-N
XLogP23.96
TPSA139.39 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms113
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001485.82
LogP ≤ 523.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine with MolForge

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Related Compounds

2-(4,4'-Di-tert-butyl-2'-(5-fluoropyridin-2-yl)-5'-(furan-2-yl)-[1,1'-biphenyl]-2-yl)-3-fluoro-4-methylpyridine
CID 155908886
6,6'-(4,4'-Di-tert-butyl-5,5'-di(furan-2-yl)-[1,1'-biphenyl]-2,2'-diyl)bis(3-fluoropyridine)
CID 155908925
1-[2-[[5-Methyl-6-[4-oxo-4-[2-(trifluoromethyl)phenyl]butanoyl]pyridin-2-yl]oxymethyl]phenyl]-4-[2-[[4-methyl-3-[4-oxo-4-[3-(trifluoromethyl)pyridin-2-yl]butanoyl]phenyl]methyl]phenyl]butane-1,4-dione
CID 123789948
Methyl 2-methyl-2-[2-[4-[[(2-methylnaphthalen-1-yl)methyl-[[5-(trifluoromethyl)furan-2-yl]methyl]amino]methyl]phenyl]pyridin-4-yl]propanoate
CID 137433305
Ethyl 2-methyl-2-[4-[4-[[(2-methylnaphthalen-1-yl)methyl-[[5-(trifluoromethyl)furan-2-yl]methyl]amino]methyl]phenyl]pyridin-2-yl]propanoate
CID 146553296
2-Methyl-2-[2-[4-[[(2-methylnaphthalen-1-yl)methyl-[[5-(trifluoromethyl)furan-2-yl]methyl]amino]methyl]phenyl]-4-pyridinyl]propanoic acid
CID 146553398
Sodium 2-methyl-2-[2-[4-[[(2-methylnaphthalen-1-yl)methyl-[[5-(trifluoromethyl)furan-2-yl]methyl]amino]methyl]phenyl]-4-pyridinyl]propanoate
CID 153486638
1-[4-[5-[2-[[(5S)-5-[3,5-bis(trifluoromethyl)phenyl]-4,5-dihydro-1,2-oxazol-3-yl]methyl]-6-methoxy-3-pyridinyl]-6-methoxy-3-pyridinyl]-3-methylphenyl]ethanone;1-[4-[5-[2-[[(4R,5S)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-4,5-dihydro-1,2-oxazol-3-yl]methyl]-4-(trifluoromethyl)phenyl]-6-methoxy-3-pyridinyl]-3,5-dimethylphenyl]ethanone;1-[4-[5-[2-[[(4R,5S)-5-[3,5-bis(trifluoromethyl)phenyl]-4-methyl-4,5-dihydro-1,2-oxazol-3-yl]methyl]-4-(trifluoromethyl)phenyl]-6-methoxy-3-pyridinyl]-3-methylphenyl]ethanone;methane
CID 157248733
1-[2-(1-Benzofuran-5-yl)-3-pyridinyl]-4-pyridin-4-ylpiperazine;1-[2-(2,3-dihydro-1-benzofuran-5-yl)-3-pyridinyl]-4-pyridin-4-ylpiperazine;1-(2-methoxy-4-pyridinyl)-4-(2-phenyl-3-pyridinyl)piperazine;1-(2-naphthalen-1-yl-3-pyridinyl)-4-pyridin-4-ylpiperazine;4-[3-(4-pyridin-4-ylpiperazin-1-yl)-2-pyridinyl]benzonitrile;1-pyridin-4-yl-4-[2-[4-(trifluoromethoxy)phenyl]-3-pyridinyl]piperazine
CID 157471947
2-(3,5-Difluoro-2-methylphenyl)-1-methylpyridin-1-ium;1-methyl-2-(1-methylnaphthalen-2-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)-6-phenylpyridin-1-ium;[4-methyl-5-(1-methylquinolin-1-ium-2-yl)furan-2-yl]methanol;[4-methyl-3-[1-methyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]phenyl]methyl formate
CID 158058096
2-(3,5-Difluoro-2-methylphenyl)-1-methylpyridin-1-ium;2-(5-methoxy-3-methylfuran-2-yl)-1-methylquinolin-1-ium;methyl 4-methyl-3-[1-methyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]benzoate;1-methyl-2-(1-methylnaphthalen-2-yl)pyridin-1-ium
CID 158111427
2-(3,5-Difluoro-2-methylphenyl)-1-methylpyridin-1-ium;6-(4-ethoxy-1-methylpyridin-1-ium-2-yl)-7-methylnaphthalene-1,4-dione;2-(5-methoxy-3-methylfuran-2-yl)-1-methylquinolin-1-ium;methyl 4-methyl-3-[1-methyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]benzoate;1-methyl-2-(1-methylnaphthalen-2-yl)pyridin-1-ium
CID 158576354

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine?
The IUPAC name of N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine (CID 158316818) is N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine.
What is the SMILES notation for N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine?
The canonical SMILES for N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine is C(=N/C(c1ccccc1)c1ccc2ccccc2c1)\c1ccccn1.C(=N/C(c1ccccc1)c1cccc2ccccc12)\c1ccccn1.C(=N/C(c1ccccc1)c1ccco1)\c1ccccn1.Cc1cc(C(/N=C/c2ccccn2)c2ccccc2)cc(C(F)(F)F)c1.Cc1ccccc1[C@H](C)/N=C/c1ccccn1.
What is the InChIKey of N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine?
The InChIKey is GOIZCXCPWWTZOR-WZNPJVJYSA-N. The full InChI is InChI=1S/2C23H18N2.C21H17F3N2.C17H14N2O.C15H16N2/c1-2-10-19(11-3-1)23(25-17-20-13-6-7-16-24-20)22-15-8-12-18-9-4-5-14-21(18)22;1-2-9-19(10-3-1)23(25-17-22-12-6-7-15-24-22)21-14-13-18-8-4-5-11-20(18)16-21;1-15-11-17(13-18(12-15)21(22,23)24)20(16-7-3-2-4-8-16)26-14-19-9-5-6-10-25-19;1-2-7-14(8-3-1)17(16-10-6-12-20-16)19-13-15-9-4-5-11-18-15;1-12-7-3-4-9-15(12)13(2)17-11-14-8-5-6-10-16-14/h2*1-17,23H;2-14,20H,1H3;1-13,17H;3-11,13H,1-2H3/b2*25-17+;26-14+;19-13+;17-11+/t;;;;13-/m....0/s1.
What are the key properties of N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine?
N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine has a molecular weight of 1485.82 g/mol, XLogP of 23.96, 19 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[(1S)-1-(2-methylphenyl)ethyl]-1-pyridin-2-ylmethanimine;N-[[3-methyl-5-(trifluoromethyl)phenyl]-phenylmethyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-1-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine;N-[naphthalen-2-yl(phenyl)methyl]-1-pyridin-2-ylmethanimine is sourced from PubChem (CID 158316818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).