9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine

C22H21N — CID 156636262

IUPAC9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine
SMILESCc1ccccc1Nc1ccc2c(c1)-c1ccccc1C2(C)C
InChIInChI=1S/C22H21N/c1-15-8-4-7-11-21(15)23-16-12-13-20-18(14-16)17-9-5-6-10-19(17)22(20,2)3/h4-14,23H,1-3H3
InChIKeyBITJNUCEEMIDJJ-UHFFFAOYSA-N
MW299.42 g/mol
LogP6.04
Rot. Bonds2

About 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine

9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine (PubChem CID 156636262) has the molecular formula C22H21N and a molecular weight of 299.42 g/mol. Its IUPAC name is 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine
PubChem CID156636262
Molecular FormulaC22H21N
Molecular Weight299.42 g/mol
Exact Mass299.17
IUPAC Name9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine
SMILESCc1ccccc1Nc1ccc2c(c1)-c1ccccc1C2(C)C
InChIInChI=1S/C22H21N/c1-15-8-4-7-11-21(15)23-16-12-13-20-18(14-16)17-9-5-6-10-19(17)22(20,2)3/h4-14,23H,1-3H3
InChIKeyBITJNUCEEMIDJJ-UHFFFAOYSA-N
XLogP6.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.42
LogP ≤ 56.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine?
The IUPAC name of 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine (CID 156636262) is 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine.
What is the SMILES notation for 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine?
The canonical SMILES for 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine is Cc1ccccc1Nc1ccc2c(c1)-c1ccccc1C2(C)C.
What is the InChIKey of 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine?
The InChIKey is BITJNUCEEMIDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N/c1-15-8-4-7-11-21(15)23-16-12-13-20-18(14-16)17-9-5-6-10-19(17)22(20,2)3/h4-14,23H,1-3H3.
What are the key properties of 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine?
9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine has a molecular weight of 299.42 g/mol, XLogP of 6.04, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-(2-methylphenyl)fluoren-3-amine is sourced from PubChem (CID 156636262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).