(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine

C16H15F2N — CID 171313299

IUPAC(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine
SMILESN[C@@H](CC(F)F)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C16H15F2N/c17-16(18)9-15(19)11-5-6-14-12(8-11)7-10-3-1-2-4-13(10)14/h1-6,8,15-16H,7,9,19H2/t15-/m0/s1
InChIKeyBQBKOERSJOPLHM-HNNXBMFYSA-N
MW259.30 g/mol
LogP3.91
Rot. Bonds3

About (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine

(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine (PubChem CID 171313299) has the molecular formula C16H15F2N and a molecular weight of 259.30 g/mol. Its IUPAC name is (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine.

Molecular Properties

Compound Name(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine
PubChem CID171313299
Molecular FormulaC16H15F2N
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC Name(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine
SMILESN[C@@H](CC(F)F)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C16H15F2N/c17-16(18)9-15(19)11-5-6-14-12(8-11)7-10-3-1-2-4-13(10)14/h1-6,8,15-16H,7,9,19H2/t15-/m0/s1
InChIKeyBQBKOERSJOPLHM-HNNXBMFYSA-N
XLogP3.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-(9H-fluoren-2-yl)-3,3,3-trifluoropropan-1-amine
CID 171213653
(1S)-1-(9H-fluoren-2-yl)butan-1-amine
CID 171233264
(1S)-1-(9H-fluoren-2-yl)-4,4,4-trifluorobutan-1-amine;hydrochloride
CID 171233279
(1S)-1-(9H-fluoren-2-yl)butane-1,4-diamine;hydrochloride
CID 171233257
1-(9H-fluoren-2-yl)-2-propan-2-ylsulfanylethanamine
CID 64634231
(2S)-2-amino-2-(9H-fluoren-3-yl)ethanol
CID 66515165
(1S)-1-(9H-fluoren-2-yl)pent-4-en-1-amine;hydrochloride
CID 171233295
(1S,2R)-1-amino-1-(9H-fluoren-2-yl)propan-2-ol
CID 171270727
(1R,2S)-1-amino-1-(9H-fluoren-2-yl)butan-2-ol
CID 171265056
(1S,2R)-1-amino-1-(9H-fluoren-2-yl)butan-2-ol
CID 171270729
2-ethylsulfinyl-1-(9H-fluoren-2-yl)ethanamine
CID 64653976
(1S,2R)-1-amino-1-(9H-fluoren-2-yl)propan-2-ol;hydrochloride
CID 171270728

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine?
The IUPAC name of (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine (CID 171313299) is (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine.
What is the SMILES notation for (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine?
The canonical SMILES for (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine is N[C@@H](CC(F)F)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine?
The InChIKey is BQBKOERSJOPLHM-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H15F2N/c17-16(18)9-15(19)11-5-6-14-12(8-11)7-10-3-1-2-4-13(10)14/h1-6,8,15-16H,7,9,19H2/t15-/m0/s1.
What are the key properties of (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine?
(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine has a molecular weight of 259.30 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine is sourced from PubChem (CID 171313299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).