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

C18H21NO — CID 57328257

IUPAC(2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol
SMILESCC[C@H](CO)NCc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C18H21NO/c1-2-16(12-20)19-11-13-7-8-18-15(9-13)10-14-5-3-4-6-17(14)18/h3-9,16,19-20H,2,10-12H2,1H3/t16-/m1/s1
InChIKeyGSICPMHTSFUQHK-MRXNPFEDSA-N
MW267.37 g/mol
LogP3.12
Rot. Bonds5

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

(2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol (PubChem CID 57328257) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol.

Molecular Properties

Compound Name(2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol
PubChem CID57328257
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name(2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol
SMILESCC[C@H](CO)NCc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C18H21NO/c1-2-16(12-20)19-11-13-7-8-18-15(9-13)10-14-5-3-4-6-17(14)18/h3-9,16,19-20H,2,10-12H2,1H3/t16-/m1/s1
InChIKeyGSICPMHTSFUQHK-MRXNPFEDSA-N
XLogP3.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
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-2-ylmethylamino)butan-1-ol?
The IUPAC name of (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol (CID 57328257) is (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol.
What is the SMILES notation for (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol?
The canonical SMILES for (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol is CC[C@H](CO)NCc1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol?
The InChIKey is GSICPMHTSFUQHK-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H21NO/c1-2-16(12-20)19-11-13-7-8-18-15(9-13)10-14-5-3-4-6-17(14)18/h3-9,16,19-20H,2,10-12H2,1H3/t16-/m1/s1.
What are the key properties of (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol?
(2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol has a molecular weight of 267.37 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(9H-fluoren-2-ylmethylamino)butan-1-ol is sourced from PubChem (CID 57328257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).