N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole

C63H60N4 — CID 144918431

IUPACN,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole
SMILESCCc1ccccc1.CCn1c2ccccc2c2cc(C)ccc21.CCn1c2ccccc2c2ccccc21.Cc1ccc2c(c1)c1cc(N(C)c3ccccc3)ccc1n2-c1ccccc1
InChIInChI=1S/C26H22N2.C15H15N.C14H13N.C8H10/c1-19-13-15-25-23(17-19)24-18-22(27(2)20-9-5-3-6-10-20)14-16-26(24)28(25)21-11-7-4-8-12-21;1-3-16-14-7-5-4-6-12(14)13-10-11(2)8-9-15(13)16;1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-2-8-6-4-3-5-7-8/h3-18H,1-2H3;4-10H,3H2,1-2H3;3-10H,2H2,1H3;3-7H,2H2,1H3
InChIKeyOASLVBHDNJRZNZ-UHFFFAOYSA-N
MW873.20 g/mol
LogP17.05
Rot. Bonds6

About N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole

N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole (PubChem CID 144918431) has the molecular formula C63H60N4 and a molecular weight of 873.20 g/mol. Its IUPAC name is N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole.

Molecular Properties

Compound NameN,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole
PubChem CID144918431
Molecular FormulaC63H60N4
Molecular Weight873.20 g/mol
Exact Mass872.48
IUPAC NameN,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole
SMILESCCc1ccccc1.CCn1c2ccccc2c2cc(C)ccc21.CCn1c2ccccc2c2ccccc21.Cc1ccc2c(c1)c1cc(N(C)c3ccccc3)ccc1n2-c1ccccc1
InChIInChI=1S/C26H22N2.C15H15N.C14H13N.C8H10/c1-19-13-15-25-23(17-19)24-18-22(27(2)20-9-5-3-6-10-20)14-16-26(24)28(25)21-11-7-4-8-12-21;1-3-16-14-7-5-4-6-12(14)13-10-11(2)8-9-15(13)16;1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-2-8-6-4-3-5-7-8/h3-18H,1-2H3;4-10H,3H2,1-2H3;3-10H,2H2,1H3;3-7H,2H2,1H3
InChIKeyOASLVBHDNJRZNZ-UHFFFAOYSA-N
XLogP17.05
TPSA18.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500873.20
LogP ≤ 517.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(4-methylphenyl)-9-phenylcarbazol-3-amine
CID 58903567
N-(4-methylphenyl)-N,9-diphenylcarbazol-3-amine
CID 90181897
3-N-(9-ethylcarbazol-3-yl)-6-N-(9-ethyl-4-methylcarbazol-3-yl)-3-N,6-N,9-triphenylcarbazole-3,6-diamine
CID 144761575
6-ethyl-N-[4-[(E)-2-[4-(N-(6-ethyl-9-phenylcarbazol-3-yl)anilino)phenyl]ethenyl]phenyl]-N,9-diphenylcarbazol-3-amine;bis(6-methyl-N-[4-[(E)-2-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]ethenyl]phenyl]-N,9-diphenylcarbazol-3-amine)
CID 159236150
3-carbazol-9-yl-N-methyl-N-phenylaniline
CID 59211086
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
N-iodo-N-(4-methylphenyl)-9-phenylcarbazol-3-amine
CID 137416306
N-[10-[3-methyl-10-[10-(N-(9-phenylcarbazol-3-yl)anilino)anthracen-9-yl]anthracen-9-yl]anthracen-9-yl]-N,9-diphenylcarbazol-3-amine
CID 59010583
N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]-N-[4-[4-(3-methylcarbazol-9-yl)phenyl]phenyl]aniline;9-ethyl-3-(9-ethylcarbazol-3-yl)-6-methylcarbazole
CID 123521263
7-ethyl-5-phenylindolo[2,3-b]carbazole
CID 139441502
2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159508303
N-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(3,6-diethylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(3,6-dimethylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 159264899

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole?
The IUPAC name of N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole (CID 144918431) is N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole.
What is the SMILES notation for N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole?
The canonical SMILES for N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole is CCc1ccccc1.CCn1c2ccccc2c2cc(C)ccc21.CCn1c2ccccc2c2ccccc21.Cc1ccc2c(c1)c1cc(N(C)c3ccccc3)ccc1n2-c1ccccc1.
What is the InChIKey of N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole?
The InChIKey is OASLVBHDNJRZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2.C15H15N.C14H13N.C8H10/c1-19-13-15-25-23(17-19)24-18-22(27(2)20-9-5-3-6-10-20)14-16-26(24)28(25)21-11-7-4-8-12-21;1-3-16-14-7-5-4-6-12(14)13-10-11(2)8-9-15(13)16;1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-2-8-6-4-3-5-7-8/h3-18H,1-2H3;4-10H,3H2,1-2H3;3-10H,2H2,1H3;3-7H,2H2,1H3.
What are the key properties of N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole?
N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole has a molecular weight of 873.20 g/mol, XLogP of 17.05, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N,9-diphenylcarbazol-3-amine;ethylbenzene;9-ethylcarbazole;9-ethyl-3-methylcarbazole is sourced from PubChem (CID 144918431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).