9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine

C198H150N12 — CID 158145528

IUPAC9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine
SMILESCCn1c2ccccc2c2cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7CC)cc5)c5cc(C)ccc45)cc3)ccc21.CCn1c2ccccc2c2cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7CC)cc5)c5ccccc45)cc3)ccc21.Cc1ccc2c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5C)cc3)c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5C)cc3)c2c1
InChIInChI=1S/C67H52N4.C66H50N4.C65H48N4/c1-4-68-62-26-16-14-22-54(62)59-43-52(37-40-64(59)68)70(48-18-8-6-9-19-48)50-33-29-46(30-34-50)66-56-24-12-13-25-57(56)67(61-42-45(3)28-39-58(61)66)47-31-35-51(36-32-47)71(49-20-10-7-11-21-49)53-38-41-65-60(44-53)55-23-15-17-27-63(55)69(65)5-2;1-3-67-61-29-17-15-23-53(61)59-43-51(39-41-63(59)67)69(47-19-7-5-8-20-47)49-35-31-45(32-36-49)65-55-25-11-13-27-57(55)66(58-28-14-12-26-56(58)65)46-33-37-50(38-34-46)70(48-21-9-6-10-22-48)52-40-42-64-60(44-52)54-24-16-18-30-62(54)68(64)4-2;1-43-26-37-56-59(40-43)65(45-29-33-49(34-30-45)69(47-18-8-5-9-19-47)51-36-39-63-58(42-51)53-21-13-15-25-61(53)67(63)3)55-23-11-10-22-54(55)64(56)44-27-31-48(32-28-44)68(46-16-6-4-7-17-46)50-35-38-62-57(41-50)52-20-12-14-24-60(52)66(62)2/h6-44H,4-5H2,1-3H3;5-44H,3-4H2,1-2H3;4-42H,1-3H3
InChIKeyFULWBMUBDFHWAI-UHFFFAOYSA-N
MW2697.46 g/mol
LogP55.22
Rot. Bonds28

About 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine

9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine (PubChem CID 158145528) has the molecular formula C198H150N12 and a molecular weight of 2697.46 g/mol. Its IUPAC name is 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine.

Molecular Properties

Compound Name9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine
PubChem CID158145528
Molecular FormulaC198H150N12
Molecular Weight2697.46 g/mol
Exact Mass2695.21
IUPAC Name9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine
SMILESCCn1c2ccccc2c2cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7CC)cc5)c5cc(C)ccc45)cc3)ccc21.CCn1c2ccccc2c2cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7CC)cc5)c5ccccc45)cc3)ccc21.Cc1ccc2c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5C)cc3)c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5C)cc3)c2c1
InChIInChI=1S/C67H52N4.C66H50N4.C65H48N4/c1-4-68-62-26-16-14-22-54(62)59-43-52(37-40-64(59)68)70(48-18-8-6-9-19-48)50-33-29-46(30-34-50)66-56-24-12-13-25-57(56)67(61-42-45(3)28-39-58(61)66)47-31-35-51(36-32-47)71(49-20-10-7-11-21-49)53-38-41-65-60(44-53)55-23-15-17-27-63(55)69(65)5-2;1-3-67-61-29-17-15-23-53(61)59-43-51(39-41-63(59)67)69(47-19-7-5-8-20-47)49-35-31-45(32-36-49)65-55-25-11-13-27-57(55)66(58-28-14-12-26-56(58)65)46-33-37-50(38-34-46)70(48-21-9-6-10-22-48)52-40-42-64-60(44-52)54-24-16-18-30-62(54)68(64)4-2;1-43-26-37-56-59(40-43)65(45-29-33-49(34-30-45)69(47-18-8-5-9-19-47)51-36-39-63-58(42-51)53-21-13-15-25-61(53)67(63)3)55-23-11-10-22-54(55)64(56)44-27-31-48(32-28-44)68(46-16-6-4-7-17-46)50-35-38-62-57(41-50)52-20-12-14-24-60(52)66(62)2/h6-44H,4-5H2,1-3H3;5-44H,3-4H2,1-2H3;4-42H,1-3H3
InChIKeyFULWBMUBDFHWAI-UHFFFAOYSA-N
XLogP55.22
TPSA49.02 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds28
Heavy Atoms210
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002697.46
LogP ≤ 555.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine with MolForge

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Related Compounds

9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine
CID 159034254
9-ethyl-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine;bis(9-methyl-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine)
CID 159037190
9-methyl-N-[4-[10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine;N-phenyl-9-(4-phenylphenyl)-N-[4-[10-[4-(N-[9-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]carbazol-3-amine
CID 161274378
N-(4-carbazol-9-ylphenyl)-4-(2-methyl-10-phenylanthracen-9-yl)-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-(3-methyl-10-phenylanthracen-9-yl)-N-phenylaniline
CID 158366051
9-methyl-N-phenyl-N-(10-phenylanthracen-9-yl)carbazol-3-amine
CID 58273861
6-methyl-N,9-diphenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine
CID 91307888
N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine
CID 59010605
6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine
CID 158721226
2-N,6-N-bis(4-methylphenyl)-2-N,6-N,9-triphenyl-10-(4-phenylphenyl)anthracene-2,6-diamine
CID 59766189
6-ethyl-N-[4-[10-[4-(N-(6-ethyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;6-methyl-N-[4-[3-methyl-10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 159561442
23-ethyl-N,N-diphenyl-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(14),2,4,6,8(13),9,11,15,17,19,21,24-dodecaen-10-amine
CID 89417765
3-N-(9-ethylcarbazol-2-yl)-1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]benzene-1,3-diamine
CID 177275887

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine?
The IUPAC name of 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine (CID 158145528) is 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine.
What is the SMILES notation for 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine?
The canonical SMILES for 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine is CCn1c2ccccc2c2cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7CC)cc5)c5cc(C)ccc45)cc3)ccc21.CCn1c2ccccc2c2cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7CC)cc5)c5ccccc45)cc3)ccc21.Cc1ccc2c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5C)cc3)c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5C)cc3)c2c1.
What is the InChIKey of 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine?
The InChIKey is FULWBMUBDFHWAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H52N4.C66H50N4.C65H48N4/c1-4-68-62-26-16-14-22-54(62)59-43-52(37-40-64(59)68)70(48-18-8-6-9-19-48)50-33-29-46(30-34-50)66-56-24-12-13-25-57(56)67(61-42-45(3)28-39-58(61)66)47-31-35-51(36-32-47)71(49-20-10-7-11-21-49)53-38-41-65-60(44-53)55-23-15-17-27-63(55)69(65)5-2;1-3-67-61-29-17-15-23-53(61)59-43-51(39-41-63(59)67)69(47-19-7-5-8-20-47)49-35-31-45(32-36-49)65-55-25-11-13-27-57(55)66(58-28-14-12-26-56(58)65)46-33-37-50(38-34-46)70(48-21-9-6-10-22-48)52-40-42-64-60(44-52)54-24-16-18-30-62(54)68(64)4-2;1-43-26-37-56-59(40-43)65(45-29-33-49(34-30-45)69(47-18-8-5-9-19-47)51-36-39-63-58(42-51)53-21-13-15-25-61(53)67(63)3)55-23-11-10-22-54(55)64(56)44-27-31-48(32-28-44)68(46-16-6-4-7-17-46)50-35-38-62-57(41-50)52-20-12-14-24-60(52)66(62)2/h6-44H,4-5H2,1-3H3;5-44H,3-4H2,1-2H3;4-42H,1-3H3.
What are the key properties of 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine?
9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine has a molecular weight of 2697.46 g/mol, XLogP of 55.22, 28 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-ethyl-N-[4-[10-[4-(N-(9-ethylcarbazol-3-yl)anilino)phenyl]-3-methylanthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine;9-methyl-N-[4-[3-methyl-10-[4-(N-(9-methylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N-phenylcarbazol-3-amine is sourced from PubChem (CID 158145528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).