3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine

C177H124N10 — CID 160761168

IUPAC3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4cc6c(ccn6-c6ccccc6)cc4n5-c4ccccc4)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3cc5c(ccn5-c5ccccc5)cc3n4-c3ccccc3)cc2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2cc(-c3ccc(N(c5ccc(-c6ccccn6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cc3)ccc2n4-c2ccccc2)cc1
InChIInChI=1S/C68H46N4.C59H43N3.C50H35N3/c1-5-17-51(18-6-1)68(52-19-7-2-8-20-52)62-26-14-13-25-58(62)59-38-37-57(45-63(59)68)71(56-35-30-48(31-36-56)64-27-15-16-41-69-64)55-33-28-47(29-34-55)49-32-39-65-60(43-49)61-46-66-50(40-42-70(66)53-21-9-3-10-22-53)44-67(61)72(65)54-23-11-4-12-24-54;1-59(2)54-21-13-12-20-50(54)51-32-31-49(38-55(51)59)61(47-27-22-41(23-28-47)40-14-6-3-7-15-40)48-29-24-42(25-30-48)43-26-33-56-52(36-43)53-39-57-44(34-35-60(57)45-16-8-4-9-17-45)37-58(53)62(56)46-18-10-5-11-19-46;1-5-13-36(14-6-1)38-21-25-43(26-22-38)52(44-27-23-39(24-28-44)37-15-7-2-8-16-37)45-29-30-48-46(34-45)47-35-49-40(31-32-51(49)41-17-9-3-10-18-41)33-50(47)53(48)42-19-11-4-12-20-42/h1-46H;3-39H,1-2H3;1-35H
InChIKeyRYBYAMAXEOHDAJ-UHFFFAOYSA-N
MW2391.01 g/mol
LogP46.66
Rot. Bonds23

About 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine

3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine (PubChem CID 160761168) has the molecular formula C177H124N10 and a molecular weight of 2391.01 g/mol. Its IUPAC name is 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine
PubChem CID160761168
Molecular FormulaC177H124N10
Molecular Weight2391.01 g/mol
Exact Mass2389.00
IUPAC Name3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4cc6c(ccn6-c6ccccc6)cc4n5-c4ccccc4)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3cc5c(ccn5-c5ccccc5)cc3n4-c3ccccc3)cc2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2cc(-c3ccc(N(c5ccc(-c6ccccn6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cc3)ccc2n4-c2ccccc2)cc1
InChIInChI=1S/C68H46N4.C59H43N3.C50H35N3/c1-5-17-51(18-6-1)68(52-19-7-2-8-20-52)62-26-14-13-25-58(62)59-38-37-57(45-63(59)68)71(56-35-30-48(31-36-56)64-27-15-16-41-69-64)55-33-28-47(29-34-55)49-32-39-65-60(43-49)61-46-66-50(40-42-70(66)53-21-9-3-10-22-53)44-67(61)72(65)54-23-11-4-12-24-54;1-59(2)54-21-13-12-20-50(54)51-32-31-49(38-55(51)59)61(47-27-22-41(23-28-47)40-14-6-3-7-15-40)48-29-24-42(25-30-48)43-26-33-56-52(36-43)53-39-57-44(34-35-60(57)45-16-8-4-9-17-45)37-58(53)62(56)46-18-10-5-11-19-46;1-5-13-36(14-6-1)38-21-25-43(26-22-38)52(44-27-23-39(24-28-44)37-15-7-2-8-16-37)45-29-30-48-46(34-45)47-35-49-40(31-32-51(49)41-17-9-3-10-18-41)33-50(47)53(48)42-19-11-4-12-20-42/h1-46H;3-39H,1-2H3;1-35H
InChIKeyRYBYAMAXEOHDAJ-UHFFFAOYSA-N
XLogP46.66
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds23
Heavy Atoms187
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002391.01
LogP ≤ 546.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine?
The IUPAC name of 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine (CID 160761168) is 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine.
What is the SMILES notation for 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine?
The canonical SMILES for 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4cc6c(ccn6-c6ccccc6)cc4n5-c4ccccc4)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3cc5c(ccn5-c5ccccc5)cc3n4-c3ccccc3)cc2)cc1.c1ccc(-n2ccc3cc4c(cc32)c2cc(-c3ccc(N(c5ccc(-c6ccccn6)cc5)c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cc3)ccc2n4-c2ccccc2)cc1.
What is the InChIKey of 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine?
The InChIKey is RYBYAMAXEOHDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H46N4.C59H43N3.C50H35N3/c1-5-17-51(18-6-1)68(52-19-7-2-8-20-52)62-26-14-13-25-58(62)59-38-37-57(45-63(59)68)71(56-35-30-48(31-36-56)64-27-15-16-41-69-64)55-33-28-47(29-34-55)49-32-39-65-60(43-49)61-46-66-50(40-42-70(66)53-21-9-3-10-22-53)44-67(61)72(65)54-23-11-4-12-24-54;1-59(2)54-21-13-12-20-50(54)51-32-31-49(38-55(51)59)61(47-27-22-41(23-28-47)40-14-6-3-7-15-40)48-29-24-42(25-30-48)43-26-33-56-52(36-43)53-39-57-44(34-35-60(57)45-16-8-4-9-17-45)37-58(53)62(56)46-18-10-5-11-19-46;1-5-13-36(14-6-1)38-21-25-43(26-22-38)52(44-27-23-39(24-28-44)37-15-7-2-8-16-37)45-29-30-48-46(34-45)47-35-49-40(31-32-51(49)41-17-9-3-10-18-41)33-50(47)53(48)42-19-11-4-12-20-42/h1-46H;3-39H,1-2H3;1-35H.
What are the key properties of 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine?
3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine has a molecular weight of 2391.01 g/mol, XLogP of 46.66, 23 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-diphenyl-N,N-bis(4-phenylphenyl)pyrrolo[3,2-b]carbazol-6-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-(3,9-diphenylpyrrolo[3,2-b]carbazol-6-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-2-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 160761168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).