6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine

C80H62N4O2 — CID 146848929

IUPAC6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine
SMILESC=Cc1ccc(-c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6cc(-c8ccc(C=C)cc8)ccc6n7-c6ccc(COC)cc6)cc5)cc4)ccc2n3-c2ccc(COC)cc2)cc1
InChIInChI=1S/C80H62N4O2/c1-5-55-17-25-61(26-18-55)63-33-45-77-73(49-63)75-51-71(43-47-79(75)83(77)69-35-21-57(22-36-69)53-85-3)81(65-13-9-7-10-14-65)67-39-29-59(30-40-67)60-31-41-68(42-32-60)82(66-15-11-8-12-16-66)72-44-48-80-76(52-72)74-50-64(62-27-19-56(6-2)20-28-62)34-46-78(74)84(80)70-37-23-58(24-38-70)54-86-4/h5-52H,1-2,53-54H2,3-4H3
InChIKeySHXRDRMKEJEFKG-UHFFFAOYSA-N
MW1111.40 g/mol
LogP21.40
Rot. Bonds17

About 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine

6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine (PubChem CID 146848929) has the molecular formula C80H62N4O2 and a molecular weight of 1111.40 g/mol. Its IUPAC name is 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine.

Molecular Properties

Compound Name6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine
PubChem CID146848929
Molecular FormulaC80H62N4O2
Molecular Weight1111.40 g/mol
Exact Mass1110.49
IUPAC Name6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine
SMILESC=Cc1ccc(-c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6cc(-c8ccc(C=C)cc8)ccc6n7-c6ccc(COC)cc6)cc5)cc4)ccc2n3-c2ccc(COC)cc2)cc1
InChIInChI=1S/C80H62N4O2/c1-5-55-17-25-61(26-18-55)63-33-45-77-73(49-63)75-51-71(43-47-79(75)83(77)69-35-21-57(22-36-69)53-85-3)81(65-13-9-7-10-14-65)67-39-29-59(30-40-67)60-31-41-68(42-32-60)82(66-15-11-8-12-16-66)72-44-48-80-76(52-72)74-50-64(62-27-19-56(6-2)20-28-62)34-46-78(74)84(80)70-37-23-58(24-38-70)54-86-4/h5-52H,1-2,53-54H2,3-4H3
InChIKeySHXRDRMKEJEFKG-UHFFFAOYSA-N
XLogP21.40
TPSA34.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001111.40
LogP ≤ 521.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine with MolForge

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Related Compounds

6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenylcarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 139320793
N-[4-[9-(4-ethenylphenyl)-6-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 142340184
4-N-[4-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]-4-N-[4-[4-[4-[9-(4-ethenylphenyl)carbazol-3-yl]-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
CID 137428819
4-N-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]-1-N-(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
CID 176734791
4-[4-(4-ethenylphenyl)phenyl]-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 58568926
6-ethenyl-N-[4-(4-methylphenyl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 166763972
6-ethenyl-N-(4-methylphenyl)-N,9-diphenylcarbazol-3-amine
CID 166764286
N-[4-[6-[(4-ethenylphenyl)methoxymethyl]-9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;7-[(4-ethenylphenyl)methoxymethyl]-N-[4-[9-[4-[(4-ethenylphenyl)methoxymethyl]phenyl]carbazol-3-yl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 159199644
6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 155073664
N-phenyl-4-(4-phenylphenyl)-N-[4-[6-phenyl-9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]phenyl]aniline
CID 122524703
1-N,3-N-bis[4-[4-[3,6-bis(4-phenylphenyl)carbazol-9-yl]phenyl]phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine
CID 59816026
N,9-diphenyl-N-[9-[4-[4-[4-[3-(N-(9-phenylcarbazol-3-yl)anilino)carbazol-9-yl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazol-3-amine
CID 172537472

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine?
The IUPAC name of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine (CID 146848929) is 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine.
What is the SMILES notation for 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine?
The canonical SMILES for 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine is C=Cc1ccc(-c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6cc(-c8ccc(C=C)cc8)ccc6n7-c6ccc(COC)cc6)cc5)cc4)ccc2n3-c2ccc(COC)cc2)cc1.
What is the InChIKey of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine?
The InChIKey is SHXRDRMKEJEFKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C80H62N4O2/c1-5-55-17-25-61(26-18-55)63-33-45-77-73(49-63)75-51-71(43-47-79(75)83(77)69-35-21-57(22-36-69)53-85-3)81(65-13-9-7-10-14-65)67-39-29-59(30-40-67)60-31-41-68(42-32-60)82(66-15-11-8-12-16-66)72-44-48-80-76(52-72)74-50-64(62-27-19-56(6-2)20-28-62)34-46-78(74)84(80)70-37-23-58(24-38-70)54-86-4/h5-52H,1-2,53-54H2,3-4H3.
What are the key properties of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine?
6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine has a molecular weight of 1111.40 g/mol, XLogP of 21.40, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine is sourced from PubChem (CID 146848929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).