N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine

C74H58N4 — CID 156554218

IUPACN,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine
SMILESCC(C)(c1ccc(C(C)(C)N(c2ccccc2)c2ccc3c(c2)c2c4c(ccc2n3-c2ccccc2)-c2ccccc2C4)cc1)N(c1ccccc1)c1ccc2c(c1)c1c3c(ccc1n2-c1ccccc1)-c1ccccc1C3
InChIInChI=1S/C74H58N4/c1-73(2,77(55-27-13-7-14-28-55)57-37-41-67-65(47-57)71-63-45-49-21-17-19-31-59(49)61(63)39-43-69(71)75(67)53-23-9-5-10-24-53)51-33-35-52(36-34-51)74(3,4)78(56-29-15-8-16-30-56)58-38-42-68-66(48-58)72-64-46-50-22-18-20-32-60(50)62(64)40-44-70(72)76(68)54-25-11-6-12-26-54/h5-44,47-48H,45-46H2,1-4H3
InChIKeyMGFUQWRESZCQQV-UHFFFAOYSA-N
MW1003.31 g/mol
LogP19.17
Rot. Bonds10

About N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine

N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine (PubChem CID 156554218) has the molecular formula C74H58N4 and a molecular weight of 1003.31 g/mol. Its IUPAC name is N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine.

Molecular Properties

Compound NameN,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine
PubChem CID156554218
Molecular FormulaC74H58N4
Molecular Weight1003.31 g/mol
Exact Mass1002.47
IUPAC NameN,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine
SMILESCC(C)(c1ccc(C(C)(C)N(c2ccccc2)c2ccc3c(c2)c2c4c(ccc2n3-c2ccccc2)-c2ccccc2C4)cc1)N(c1ccccc1)c1ccc2c(c1)c1c3c(ccc1n2-c1ccccc1)-c1ccccc1C3
InChIInChI=1S/C74H58N4/c1-73(2,77(55-27-13-7-14-28-55)57-37-41-67-65(47-57)71-63-45-49-21-17-19-31-59(49)61(63)39-43-69(71)75(67)53-23-9-5-10-24-53)51-33-35-52(36-34-51)74(3,4)78(56-29-15-8-16-30-56)58-38-42-68-66(48-58)72-64-46-50-22-18-20-32-60(50)62(64)40-44-70(72)76(68)54-25-11-6-12-26-54/h5-44,47-48H,45-46H2,1-4H3
InChIKeyMGFUQWRESZCQQV-UHFFFAOYSA-N
XLogP19.17
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001003.31
LogP ≤ 519.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine?
The IUPAC name of N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine (CID 156554218) is N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine.
What is the SMILES notation for N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine?
The canonical SMILES for N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine is CC(C)(c1ccc(C(C)(C)N(c2ccccc2)c2ccc3c(c2)c2c4c(ccc2n3-c2ccccc2)-c2ccccc2C4)cc1)N(c1ccccc1)c1ccc2c(c1)c1c3c(ccc1n2-c1ccccc1)-c1ccccc1C3.
What is the InChIKey of N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine?
The InChIKey is MGFUQWRESZCQQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H58N4/c1-73(2,77(55-27-13-7-14-28-55)57-37-41-67-65(47-57)71-63-45-49-21-17-19-31-59(49)61(63)39-43-69(71)75(67)53-23-9-5-10-24-53)51-33-35-52(36-34-51)74(3,4)78(56-29-15-8-16-30-56)58-38-42-68-66(48-58)72-64-46-50-22-18-20-32-60(50)62(64)40-44-70(72)76(68)54-25-11-6-12-26-54/h5-44,47-48H,45-46H2,1-4H3.
What are the key properties of N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine?
N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine has a molecular weight of 1003.31 g/mol, XLogP of 19.17, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-diphenyl-N-[2-[4-[2-(N-(5-phenyl-12H-indeno[1,2-c]carbazol-2-yl)anilino)propan-2-yl]phenyl]propan-2-yl]-12H-indeno[1,2-c]carbazol-2-amine is sourced from PubChem (CID 156554218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).