9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine

C42H33N — CID 164774638

IUPAC9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
SMILESCc1ccccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2ccccc2c1-c1cccc2ccccc12
InChIInChI=1S/C42H33N/c1-28-13-4-11-22-39(28)43(31-24-25-35-34-19-9-10-21-37(34)42(2,3)38(35)27-31)40-26-23-30-15-6-8-18-33(30)41(40)36-20-12-16-29-14-5-7-17-32(29)36/h4-27H,1-3H3
InChIKeyWOWZAWJXUQGJIA-UHFFFAOYSA-N
MW551.73 g/mol
LogP11.74
Rot. Bonds4

About 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine

9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine (PubChem CID 164774638) has the molecular formula C42H33N and a molecular weight of 551.73 g/mol. Its IUPAC name is 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
PubChem CID164774638
Molecular FormulaC42H33N
Molecular Weight551.73 g/mol
Exact Mass551.26
IUPAC Name9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
SMILESCc1ccccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2ccccc2c1-c1cccc2ccccc12
InChIInChI=1S/C42H33N/c1-28-13-4-11-22-39(28)43(31-24-25-35-34-19-9-10-21-37(34)42(2,3)38(35)27-31)40-26-23-30-15-6-8-18-33(30)41(40)36-20-12-16-29-14-5-7-17-32(29)36/h4-27H,1-3H3
InChIKeyWOWZAWJXUQGJIA-UHFFFAOYSA-N
XLogP11.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500551.73
LogP ≤ 511.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(2-phenylphenyl)fluoren-2-amine
CID 164774447
9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(3-phenylphenyl)fluoren-2-amine
CID 164774882
N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-1-ylphenyl)fluoren-2-amine
CID 121323104
9,9-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-3-amine
CID 164774413
N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
CID 164774361
9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-(2-naphthalen-2-yl-4-phenylphenyl)fluoren-2-amine
CID 164774109
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
CID 58983323
11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-2-amine
CID 164774822
N-(3-cyclohexylphenyl)-9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
CID 164774507
N-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-N-(4-naphthalen-1-ylphenyl)benzo[a]phenalen-1-amine
CID 167232336
N-(6-cyclohexylnaphthalen-2-yl)-9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
CID 164774478
5-tert-butyl-N-(9,9-dimethylfluoren-3-yl)-9,9-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine
CID 168802398

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine (CID 164774638) is 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine is Cc1ccccc1N(c1ccc2c(c1)C(C)(C)c1ccccc1-2)c1ccc2ccccc2c1-c1cccc2ccccc12.
What is the InChIKey of 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine?
The InChIKey is WOWZAWJXUQGJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H33N/c1-28-13-4-11-22-39(28)43(31-24-25-35-34-19-9-10-21-37(34)42(2,3)38(35)27-31)40-26-23-30-15-6-8-18-33(30)41(40)36-20-12-16-29-14-5-7-17-32(29)36/h4-27H,1-3H3.
What are the key properties of 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine?
9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine has a molecular weight of 551.73 g/mol, XLogP of 11.74, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-(2-methylphenyl)-N-(1-naphthalen-1-ylnaphthalen-2-yl)fluoren-2-amine is sourced from PubChem (CID 164774638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).