(2R)-2-(9H-fluoren-9-ylamino)butan-1-ol

C17H19NO — CID 28723501

IUPAC(2R)-2-(9H-fluoren-9-ylamino)butan-1-ol
SMILESCC[C@H](CO)NC1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H19NO/c1-2-12(11-19)18-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17-19H,2,11H2,1H3/t12-/m1/s1
InChIKeyOIUCHXFOZRFKKX-GFCCVEGCSA-N
MW253.35 g/mol
LogP3.12
Rot. Bonds4

About (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol

(2R)-2-(9H-fluoren-9-ylamino)butan-1-ol (PubChem CID 28723501) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol.

Molecular Properties

Compound Name(2R)-2-(9H-fluoren-9-ylamino)butan-1-ol
PubChem CID28723501
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(2R)-2-(9H-fluoren-9-ylamino)butan-1-ol
SMILESCC[C@H](CO)NC1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H19NO/c1-2-12(11-19)18-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17-19H,2,11H2,1H3/t12-/m1/s1
InChIKeyOIUCHXFOZRFKKX-GFCCVEGCSA-N
XLogP3.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol?
The IUPAC name of (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol (CID 28723501) is (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol.
What is the SMILES notation for (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol?
The canonical SMILES for (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol is CC[C@H](CO)NC1c2ccccc2-c2ccccc21.
What is the InChIKey of (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol?
The InChIKey is OIUCHXFOZRFKKX-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H19NO/c1-2-12(11-19)18-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17-19H,2,11H2,1H3/t12-/m1/s1.
What are the key properties of (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol?
(2R)-2-(9H-fluoren-9-ylamino)butan-1-ol has a molecular weight of 253.35 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(9H-fluoren-9-ylamino)butan-1-ol is sourced from PubChem (CID 28723501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).