2,9,9-trimethylfluoren-1-amine

C16H17N — CID 142604621

IUPAC2,9,9-trimethylfluoren-1-amine
SMILESCc1ccc2c(c1N)C(C)(C)c1ccccc1-2
InChIInChI=1S/C16H17N/c1-10-8-9-12-11-6-4-5-7-13(11)16(2,3)14(12)15(10)17/h4-9H,17H2,1-3H3
InChIKeyWQROOMWIZHNFJK-UHFFFAOYSA-N
MW223.32 g/mol
LogP3.88
Rot. Bonds

About 2,9,9-trimethylfluoren-1-amine

2,9,9-trimethylfluoren-1-amine (PubChem CID 142604621) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 2,9,9-trimethylfluoren-1-amine.

Molecular Properties

Compound Name2,9,9-trimethylfluoren-1-amine
PubChem CID142604621
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name2,9,9-trimethylfluoren-1-amine
SMILESCc1ccc2c(c1N)C(C)(C)c1ccccc1-2
InChIInChI=1S/C16H17N/c1-10-8-9-12-11-6-4-5-7-13(11)16(2,3)14(12)15(10)17/h4-9H,17H2,1-3H3
InChIKeyWQROOMWIZHNFJK-UHFFFAOYSA-N
XLogP3.88
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2,9,9-trimethyl-1-(2-methylphenyl)fluorene
CID 145007121
2-(9,9-dimethylfluoren-1-yl)-9,9'-spirobi[fluorene]-1-amine
CID 175695461
1-methyl-2-(2,9,9-trimethylfluoren-1-yl)quinolin-1-ium
CID 164787286
5-deuterio-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium
CID 161312540
9,9-dimethyl-1-phenylfluorene;methane
CID 142541097
9,9-dimethylfluoren-2-amine;sulfane
CID 142283327
ethane;4,9,9-trimethylfluorene
CID 123917181
7-chloro-1-(9,9-dimethylfluoren-1-yl)-9,9-dimethylfluorene
CID 171439038
11,11-dimethylbenzo[a]fluorene;ethane
CID 144938734
3-methyl-6-phenylbenzene-1,2-diamine;3-phenylbenzene-1,2-diamine
CID 67882576
1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium
CID 158916879
9,9-dimethyl-1-naphthalen-1-ylfluorene
CID 144938636

Frequently Asked Questions

What is the IUPAC name of 2,9,9-trimethylfluoren-1-amine?
The IUPAC name of 2,9,9-trimethylfluoren-1-amine (CID 142604621) is 2,9,9-trimethylfluoren-1-amine.
What is the SMILES notation for 2,9,9-trimethylfluoren-1-amine?
The canonical SMILES for 2,9,9-trimethylfluoren-1-amine is Cc1ccc2c(c1N)C(C)(C)c1ccccc1-2.
What is the InChIKey of 2,9,9-trimethylfluoren-1-amine?
The InChIKey is WQROOMWIZHNFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-10-8-9-12-11-6-4-5-7-13(11)16(2,3)14(12)15(10)17/h4-9H,17H2,1-3H3.
What are the key properties of 2,9,9-trimethylfluoren-1-amine?
2,9,9-trimethylfluoren-1-amine has a molecular weight of 223.32 g/mol, XLogP of 3.88, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9,9-trimethylfluoren-1-amine is sourced from PubChem (CID 142604621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).