N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine

C26H23N3 — CID 144573905

IUPACN,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine
SMILESCN(c1ccc(-c2ncccn2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C26H23N3/c1-26(2)23-8-5-4-7-21(23)22-14-13-20(17-24(22)26)29(3)19-11-9-18(10-12-19)25-27-15-6-16-28-25/h4-17H,1-3H3
InChIKeyFUXIBXWKLYCTAO-UHFFFAOYSA-N
MW377.49 g/mol
LogP6.22
Rot. Bonds3

About N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine

N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine (PubChem CID 144573905) has the molecular formula C26H23N3 and a molecular weight of 377.49 g/mol. Its IUPAC name is N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine.

Molecular Properties

Compound NameN,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine
PubChem CID144573905
Molecular FormulaC26H23N3
Molecular Weight377.49 g/mol
Exact Mass377.19
IUPAC NameN,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine
SMILESCN(c1ccc(-c2ncccn2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C26H23N3/c1-26(2)23-8-5-4-7-21(23)22-14-13-20(17-24(22)26)29(3)19-11-9-18(10-12-19)25-27-15-6-16-28-25/h4-17H,1-3H3
InChIKeyFUXIBXWKLYCTAO-UHFFFAOYSA-N
XLogP6.22
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.49
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethenylphenyl)-N,9,9-trimethylfluoren-2-amine
CID 23530073
N,9,9-trimethyl-N-[3-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 166028533
N,9,9-trimethyl-N-[3-(2-phenylphenyl)phenyl]fluoren-2-amine
CID 166028580
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,9,9-trimethylfluoren-2-amine
CID 58903663
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,3,5-trimethylaniline;ethane
CID 143983290
N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine
CID 70891282
N,9,9-trimethyl-N-(2-methyl-4-phenylphenyl)fluoren-2-amine
CID 149403769
2-[7-[7-[9,9-dimethyl-2-(4-phenylphenyl)fluoren-3-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]pyrimidine
CID 58880891
4-N,4-N-bis(9,9-dimethylfluoren-2-yl)-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 23561786
4-N-(9,9-dimethylfluoren-2-yl)-1-N,1-N-diphenyl-4-N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine
CID 59025126
N-(9,9-dimethylfluoren-2-yl)-N-methyl-9,9-diphenylspiro[anthracene-10,9'-fluorene]-3'-amine
CID 142480618
2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-(4-pyrimidin-2-ylphenyl)-1,10-phenanthroline
CID 134167628

Frequently Asked Questions

What is the IUPAC name of N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine?
The IUPAC name of N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine (CID 144573905) is N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine.
What is the SMILES notation for N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine?
The canonical SMILES for N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine is CN(c1ccc(-c2ncccn2)cc1)c1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine?
The InChIKey is FUXIBXWKLYCTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N3/c1-26(2)23-8-5-4-7-21(23)22-14-13-20(17-24(22)26)29(3)19-11-9-18(10-12-19)25-27-15-6-16-28-25/h4-17H,1-3H3.
What are the key properties of N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine?
N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine has a molecular weight of 377.49 g/mol, XLogP of 6.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,9,9-trimethyl-N-(4-pyrimidin-2-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 144573905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).