4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine

C122H186N10S2 — CID 161419881

IUPAC4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine
SMILESC(=Cc1cccs1)c1ccnc(-c2cc(C=Cc3cccs3)ccn2)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CN(C)c1ccc(C=Cc2ccnc(-c3cc(C=Cc4ccc(N(C)C)cc4)c4ccccc4n3)c2)cc1.CN(C)c1ccc(C=Cc2ccnc(-c3cc(C=Cc4ccc(N(C)C)cc4)ccn3)c2)cc1
InChIInChI=1S/C34H32N4.C30H30N4.C22H16N2S2.18C2H6/c1-37(2)29-17-12-25(13-18-29)9-10-27-21-22-35-33(23-27)34-24-28(31-7-5-6-8-32(31)36-34)16-11-26-14-19-30(20-15-26)38(3)4;1-33(2)27-13-9-23(10-14-27)5-7-25-17-19-31-29(21-25)30-22-26(18-20-32-30)8-6-24-11-15-28(16-12-24)34(3)4;1-3-19(25-13-1)7-5-17-9-11-23-21(15-17)22-16-18(10-12-24-22)6-8-20-4-2-14-26-20;18*1-2/h5-24H,1-4H3;5-22H,1-4H3;1-16H;18*1-2H3
InChIKeyVWOWTVKNBJJQCX-UHFFFAOYSA-N
MW1857.03 g/mol
LogP39.47
Rot. Bonds19

About 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine

4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine (PubChem CID 161419881) has the molecular formula C122H186N10S2 and a molecular weight of 1857.03 g/mol. Its IUPAC name is 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine
PubChem CID161419881
Molecular FormulaC122H186N10S2
Molecular Weight1857.03 g/mol
Exact Mass1855.43
IUPAC Name4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine
SMILESC(=Cc1cccs1)c1ccnc(-c2cc(C=Cc3cccs3)ccn2)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CN(C)c1ccc(C=Cc2ccnc(-c3cc(C=Cc4ccc(N(C)C)cc4)c4ccccc4n3)c2)cc1.CN(C)c1ccc(C=Cc2ccnc(-c3cc(C=Cc4ccc(N(C)C)cc4)ccn3)c2)cc1
InChIInChI=1S/C34H32N4.C30H30N4.C22H16N2S2.18C2H6/c1-37(2)29-17-12-25(13-18-29)9-10-27-21-22-35-33(23-27)34-24-28(31-7-5-6-8-32(31)36-34)16-11-26-14-19-30(20-15-26)38(3)4;1-33(2)27-13-9-23(10-14-27)5-7-25-17-19-31-29(21-25)30-22-26(18-20-32-30)8-6-24-11-15-28(16-12-24)34(3)4;1-3-19(25-13-1)7-5-17-9-11-23-21(15-17)22-16-18(10-12-24-22)6-8-20-4-2-14-26-20;18*1-2/h5-24H,1-4H3;5-22H,1-4H3;1-16H;18*1-2H3
InChIKeyVWOWTVKNBJJQCX-UHFFFAOYSA-N
XLogP39.47
TPSA90.30 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds19
Heavy Atoms134
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001857.03
LogP ≤ 539.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}

Analyze 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine with MolForge

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Related Compounds

4-[2-[2-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]quinolin-4-yl]ethenyl]-N,N-dimethylaniline
CID 7085505
4-[(E)-2-[2-[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;bis(2-pyridin-2-ylpyridine);ruthenium
CID 156734947
N,N-diphenyl-4-[2-[2-[4-[2-[4-(N-phenylanilino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]aniline
CID 69478350
4-[(1E,3E)-4-[2-[(1E,3E)-4-[4-(dimethylamino)phenyl]buta-1,3-dienyl]quinolin-4-yl]buta-1,3-dienyl]-N,N-dimethylaniline
CID 20724554
N,N-dimethyl-4-[(1Z,3Z)-4-quinolin-4-ylbuta-1,3-dienyl]aniline
CID 53315181
N,N-dimethyl-4-[(E)-2-(6-phenylquinolin-4-yl)ethenyl]aniline
CID 6052008
N-[4-[(E)-2-quinolin-4-ylethenyl]phenyl]-1-thiophen-2-ylmethanimine
CID 53315556
3-methoxy-4-[(E)-2-[3-methoxy-4-[(E)-2-thiophen-2-ylethenyl]phenyl]ethenyl]-N,N-diphenylaniline
CID 20603543
tris(4-[(E)-2-phenylethenyl]-2-[4-[(E)-2-phenylethenyl]-2-pyridinyl]pyridine);ruthenium
CID 156734955
4-[(E)-2-thiophen-2-ylethenyl]pyridine
CID 10932177
N,N-diphenyl-3-[(E)-2-[4-[(E)-2-thiophen-2-ylethenyl]phenyl]ethenyl]aniline
CID 20603581
4-[(E)-2-benzo[f]quinolin-2-ylethenyl]-N,N-dimethylaniline
CID 53315199

Frequently Asked Questions

What is the IUPAC name of 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine?
The IUPAC name of 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine (CID 161419881) is 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine.
What is the SMILES notation for 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine?
The canonical SMILES for 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine is C(=Cc1cccs1)c1ccnc(-c2cc(C=Cc3cccs3)ccn2)c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CN(C)c1ccc(C=Cc2ccnc(-c3cc(C=Cc4ccc(N(C)C)cc4)c4ccccc4n3)c2)cc1.CN(C)c1ccc(C=Cc2ccnc(-c3cc(C=Cc4ccc(N(C)C)cc4)ccn3)c2)cc1.
What is the InChIKey of 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine?
The InChIKey is VWOWTVKNBJJQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32N4.C30H30N4.C22H16N2S2.18C2H6/c1-37(2)29-17-12-25(13-18-29)9-10-27-21-22-35-33(23-27)34-24-28(31-7-5-6-8-32(31)36-34)16-11-26-14-19-30(20-15-26)38(3)4;1-33(2)27-13-9-23(10-14-27)5-7-25-17-19-31-29(21-25)30-22-26(18-20-32-30)8-6-24-11-15-28(16-12-24)34(3)4;1-3-19(25-13-1)7-5-17-9-11-23-21(15-17)22-16-18(10-12-24-22)6-8-20-4-2-14-26-20;18*1-2/h5-24H,1-4H3;5-22H,1-4H3;1-16H;18*1-2H3.
What are the key properties of 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine?
4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine has a molecular weight of 1857.03 g/mol, XLogP of 39.47, 19 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]-2-pyridinyl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;4-[2-[2-[4-[2-[4-(dimethylamino)phenyl]ethenyl]quinolin-2-yl]-4-pyridinyl]ethenyl]-N,N-dimethylaniline;ethane;4-(2-thiophen-2-ylethenyl)-2-[4-(2-thiophen-2-ylethenyl)-2-pyridinyl]pyridine is sourced from PubChem (CID 161419881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).