N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine

C39H30N2 — CID 155004339

IUPACN-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccccc3)c3cccc4c5ccccc5n(-c5ccccc5)c34)ccc21
InChIInChI=1S/C39H30N2/c1-39(2)34-21-11-9-18-30(34)33-26-29(24-25-35(33)39)40(27-14-5-3-6-15-27)37-23-13-20-32-31-19-10-12-22-36(31)41(38(32)37)28-16-7-4-8-17-28/h3-26H,1-2H3
InChIKeySPCFKXQMPOQICX-UHFFFAOYSA-N
MW526.68 g/mol
LogP10.56
Rot. Bonds4

About N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine

N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine (PubChem CID 155004339) has the molecular formula C39H30N2 and a molecular weight of 526.68 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine
PubChem CID155004339
Molecular FormulaC39H30N2
Molecular Weight526.68 g/mol
Exact Mass526.24
IUPAC NameN-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccccc3)c3cccc4c5ccccc5n(-c5ccccc5)c34)ccc21
InChIInChI=1S/C39H30N2/c1-39(2)34-21-11-9-18-30(34)33-26-29(24-25-35(33)39)40(27-14-5-3-6-15-27)37-23-13-20-32-31-19-10-12-22-36(31)41(38(32)37)28-16-7-4-8-17-28/h3-26H,1-2H3
InChIKeySPCFKXQMPOQICX-UHFFFAOYSA-N
XLogP10.56
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.68
LogP ≤ 510.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(9,9-dimethylfluoren-3-yl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-1-amine
CID 170119634
N,N-bis(9,9-dimethylfluoren-3-yl)-9-phenylcarbazol-3-amine
CID 90261832
N-(9,9-dimethylfluoren-2-yl)-6-fluoro-9-phenyl-N-(9-phenylcarbazol-1-yl)carbazol-1-amine
CID 138549073
N-(9,9-dimethylfluoren-3-yl)-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-3-amine
CID 139567817
N-[4-[4-[(9,9-dimethylfluoren-3-yl)-(9-phenylcarbazol-2-yl)amino]phenyl]phenyl]-N,9-diphenylcarbazol-2-amine
CID 134164505
9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-(2-phenylphenyl)fluoren-2-amine
CID 177080212
N-(9,9-dimethylfluoren-3-yl)-11-phenyl-N-(3-phenylphenyl)benzo[a]carbazol-2-amine
CID 166847815
1-N-(9,9-dimethylfluoren-3-yl)-1-N,4-N-bis(4-methylphenyl)-4-N-(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 71249275
9,9-dimethyl-N-(4-phenylphenyl)-N-[2-[8-[9-(3-phenylphenyl)carbazol-1-yl]naphthalen-1-yl]phenyl]fluoren-3-amine
CID 169016086
N-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]fluoren-2-amine
CID 139568156
N-(9,9-dimethylfluoren-3-yl)-9-phenyl-N-[3-phenyl-2-(2-phenylphenyl)phenyl]carbazol-3-amine
CID 167286124
9,9-dimethyl-N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 168790284

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine?
The IUPAC name of N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine (CID 155004339) is N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine is CC1(C)c2ccccc2-c2cc(N(c3ccccc3)c3cccc4c5ccccc5n(-c5ccccc5)c34)ccc21.
What is the InChIKey of N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine?
The InChIKey is SPCFKXQMPOQICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H30N2/c1-39(2)34-21-11-9-18-30(34)33-26-29(24-25-35(33)39)40(27-14-5-3-6-15-27)37-23-13-20-32-31-19-10-12-22-36(31)41(38(32)37)28-16-7-4-8-17-28/h3-26H,1-2H3.
What are the key properties of N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine?
N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine has a molecular weight of 526.68 g/mol, XLogP of 10.56, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-3-yl)-N,9-diphenylcarbazol-1-amine is sourced from PubChem (CID 155004339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).