7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine

C40H32N2 — CID 58903695

IUPAC7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine
SMILESCN(c1cccc(-c2ccccc2)c1)c1ccc2c(c1)C(C)(C)c1cc(-n3c4ccccc4c4ccccc43)ccc1-2
InChIInChI=1S/C40H32N2/c1-40(2)36-25-30(41(3)29-15-11-14-28(24-29)27-12-5-4-6-13-27)20-22-32(36)33-23-21-31(26-37(33)40)42-38-18-9-7-16-34(38)35-17-8-10-19-39(35)42/h4-26H,1-3H3
InChIKeyQUTNTZCDLZZMAB-UHFFFAOYSA-N
MW540.71 g/mol
LogP10.52
Rot. Bonds4

About 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine

7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine (PubChem CID 58903695) has the molecular formula C40H32N2 and a molecular weight of 540.71 g/mol. Its IUPAC name is 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine
PubChem CID58903695
Molecular FormulaC40H32N2
Molecular Weight540.71 g/mol
Exact Mass540.26
IUPAC Name7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine
SMILESCN(c1cccc(-c2ccccc2)c1)c1ccc2c(c1)C(C)(C)c1cc(-n3c4ccccc4c4ccccc43)ccc1-2
InChIInChI=1S/C40H32N2/c1-40(2)36-25-30(41(3)29-15-11-14-28(24-29)27-12-5-4-6-13-27)20-22-32(36)33-23-21-31(26-37(33)40)42-38-18-9-7-16-34(38)35-17-8-10-19-39(35)42/h4-26H,1-3H3
InChIKeyQUTNTZCDLZZMAB-UHFFFAOYSA-N
XLogP10.52
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms42
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500540.71
LogP ≤ 510.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine?
The IUPAC name of 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine (CID 58903695) is 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine is CN(c1cccc(-c2ccccc2)c1)c1ccc2c(c1)C(C)(C)c1cc(-n3c4ccccc4c4ccccc43)ccc1-2.
What is the InChIKey of 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine?
The InChIKey is QUTNTZCDLZZMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H32N2/c1-40(2)36-25-30(41(3)29-15-11-14-28(24-29)27-12-5-4-6-13-27)20-22-32(36)33-23-21-31(26-37(33)40)42-38-18-9-7-16-34(38)35-17-8-10-19-39(35)42/h4-26H,1-3H3.
What are the key properties of 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine?
7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine has a molecular weight of 540.71 g/mol, XLogP of 10.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-carbazol-9-yl-N,9,9-trimethyl-N-(3-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 58903695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).