(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride

C19H24ClNO — CID 171265069

IUPAC(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride
SMILESCC(C)(C)[C@H](O)[C@H](N)c1ccc2c(c1)Cc1ccccc1-2.Cl
InChIInChI=1S/C19H23NO.ClH/c1-19(2,3)18(21)17(20)13-8-9-16-14(11-13)10-12-6-4-5-7-15(12)16;/h4-9,11,17-18,21H,10,20H2,1-3H3;1H/t17-,18-;/m1./s1
InChIKeyAFAPWZXLRBTXII-JAXOOIEVSA-N
MW317.86 g/mol
LogP4.09
Rot. Bonds2

About (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride

(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride (PubChem CID 171265069) has the molecular formula C19H24ClNO and a molecular weight of 317.86 g/mol. Its IUPAC name is (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride.

Molecular Properties

Compound Name(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride
PubChem CID171265069
Molecular FormulaC19H24ClNO
Molecular Weight317.86 g/mol
Exact Mass317.15
IUPAC Name(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride
SMILESCC(C)(C)[C@H](O)[C@H](N)c1ccc2c(c1)Cc1ccccc1-2.Cl
InChIInChI=1S/C19H23NO.ClH/c1-19(2,3)18(21)17(20)13-8-9-16-14(11-13)10-12-6-4-5-7-15(12)16;/h4-9,11,17-18,21H,10,20H2,1-3H3;1H/t17-,18-;/m1./s1
InChIKeyAFAPWZXLRBTXII-JAXOOIEVSA-N
XLogP4.09
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.86
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,2R)-1-amino-1-(9H-fluoren-2-yl)propan-2-ol;hydrochloride
CID 171270728
(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
(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3-phenylpropan-2-ol;hydrochloride
CID 171265081
(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine
CID 171313299
3-amino-1-(9H-fluoren-2-yl)propane-1,2-diol
CID 170829007
2-amino-1-(9H-fluoren-2-yl)ethanol
CID 14023206
(4-aminophenyl)-(9H-fluoren-2-yl)methanol
CID 91678822
(R)-cyclopropyl(9H-fluoren-2-yl)methanamine;hydrochloride
CID 171213662
(1S)-1-(9H-fluoren-2-yl)butan-1-amine
CID 171233264
(S)-9H-fluoren-2-yl(thiophen-3-yl)methanamine;hydrochloride
CID 171213670

Frequently Asked Questions

What is the IUPAC name of (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride?
The IUPAC name of (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride (CID 171265069) is (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride.
What is the SMILES notation for (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride?
The canonical SMILES for (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride is CC(C)(C)[C@H](O)[C@H](N)c1ccc2c(c1)Cc1ccccc1-2.Cl.
What is the InChIKey of (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride?
The InChIKey is AFAPWZXLRBTXII-JAXOOIEVSA-N. The full InChI is InChI=1S/C19H23NO.ClH/c1-19(2,3)18(21)17(20)13-8-9-16-14(11-13)10-12-6-4-5-7-15(12)16;/h4-9,11,17-18,21H,10,20H2,1-3H3;1H/t17-,18-;/m1./s1.
What are the key properties of (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride?
(1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride has a molecular weight of 317.86 g/mol, XLogP of 4.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S)-1-amino-1-(9H-fluoren-2-yl)-3,3-dimethylbutan-2-ol;hydrochloride is sourced from PubChem (CID 171265069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).