2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole

C38H34N2 — CID 143119204

IUPAC2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole
SMILESC=Cc1c(C)n(-c2ccc(C(C)(C)c3ccc(-n4c(C=C)c(C=C)c5ccccc54)cc3)cc2)c2ccccc12
InChIInChI=1S/C38H34N2/c1-7-31-26(4)39(36-16-12-10-14-33(31)36)29-22-18-27(19-23-29)38(5,6)28-20-24-30(25-21-28)40-35(9-3)32(8-2)34-15-11-13-17-37(34)40/h7-25H,1-3H2,4-6H3
InChIKeyFNBHZTYMBIZJOX-UHFFFAOYSA-N
MW518.70 g/mol
LogP10.14
Rot. Bonds7

About 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole

2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole (PubChem CID 143119204) has the molecular formula C38H34N2 and a molecular weight of 518.70 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole.

Molecular Properties

Compound Name2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole
PubChem CID143119204
Molecular FormulaC38H34N2
Molecular Weight518.70 g/mol
Exact Mass518.27
IUPAC Name2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole
SMILESC=Cc1c(C)n(-c2ccc(C(C)(C)c3ccc(-n4c(C=C)c(C=C)c5ccccc54)cc3)cc2)c2ccccc12
InChIInChI=1S/C38H34N2/c1-7-31-26(4)39(36-16-12-10-14-33(31)36)29-22-18-27(19-23-29)38(5,6)28-20-24-30(25-21-28)40-35(9-3)32(8-2)34-15-11-13-17-37(34)40/h7-25H,1-3H2,4-6H3
InChIKeyFNBHZTYMBIZJOX-UHFFFAOYSA-N
XLogP10.14
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.70
LogP ≤ 510.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-bis(ethenyl)-1-(4-methylphenyl)indole
CID 91187792
CID 157105979
CID 157105979
ethane;2-ethenyl-1-phenyl-3-[(Z)-prop-1-enyl]indole
CID 176690298
4-N-[4-[4-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 137384769
[4-[2-ethenyl-3-[(Z)-prop-1-enyl]indol-1-yl]phenyl]boronic acid
CID 167453480
1-(2,2-dimethylpropyl)-2,3-bis(ethenyl)indole
CID 174116280
9-[4-[4-[2,3-bis(ethenyl)indol-1-yl]phenyl]phenyl]-2,3-dihydrocarbazole
CID 144858517
2,3-bis(ethenyl)-1-(2-iodopropan-2-yl)indole
CID 166663898
4-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]-N-phenylaniline
CID 143438004
9-[4-[3-(4-carbazol-9-ylphenyl)-5-[4-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]phenyl]phenyl]carbazole
CID 174303299
5-bromo-3-ethenyl-2-methyl-1-phenylindole
CID 123907696
1-(4-hydroxyphenyl)-2-methylindole-3-carbaldehyde
CID 87772568

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole?
The IUPAC name of 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole (CID 143119204) is 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole.
What is the SMILES notation for 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole?
The canonical SMILES for 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole is C=Cc1c(C)n(-c2ccc(C(C)(C)c3ccc(-n4c(C=C)c(C=C)c5ccccc54)cc3)cc2)c2ccccc12.
What is the InChIKey of 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole?
The InChIKey is FNBHZTYMBIZJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H34N2/c1-7-31-26(4)39(36-16-12-10-14-33(31)36)29-22-18-27(19-23-29)38(5,6)28-20-24-30(25-21-28)40-35(9-3)32(8-2)34-15-11-13-17-37(34)40/h7-25H,1-3H2,4-6H3.
What are the key properties of 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole?
2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole has a molecular weight of 518.70 g/mol, XLogP of 10.14, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-1-[4-[2-[4-(3-ethenyl-2-methylindol-1-yl)phenyl]propan-2-yl]phenyl]indole is sourced from PubChem (CID 143119204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).