N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine

C23H23N — CID 70891282

IUPACN,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine
SMILESCc1ccccc1N(C)c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H23N/c1-16-9-5-8-12-22(16)24(4)17-13-14-19-18-10-6-7-11-20(18)23(2,3)21(19)15-17/h5-15H,1-4H3
InChIKeyMFCALPLDOWYERJ-UHFFFAOYSA-N
MW313.44 g/mol
LogP6.07
Rot. Bonds2

About N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine

N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine (PubChem CID 70891282) has the molecular formula C23H23N and a molecular weight of 313.44 g/mol. Its IUPAC name is N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine
PubChem CID70891282
Molecular FormulaC23H23N
Molecular Weight313.44 g/mol
Exact Mass313.18
IUPAC NameN,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine
SMILESCc1ccccc1N(C)c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H23N/c1-16-9-5-8-12-22(16)24(4)17-13-14-19-18-10-6-7-11-20(18)23(2,3)21(19)15-17/h5-15H,1-4H3
InChIKeyMFCALPLDOWYERJ-UHFFFAOYSA-N
XLogP6.07
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.44
LogP ≤ 56.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine?
The IUPAC name of N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine (CID 70891282) is N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine.
What is the SMILES notation for N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine?
The canonical SMILES for N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine is Cc1ccccc1N(C)c1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine?
The InChIKey is MFCALPLDOWYERJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N/c1-16-9-5-8-12-22(16)24(4)17-13-14-19-18-10-6-7-11-20(18)23(2,3)21(19)15-17/h5-15H,1-4H3.
What are the key properties of N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine?
N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine has a molecular weight of 313.44 g/mol, XLogP of 6.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine is sourced from PubChem (CID 70891282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).