(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine

C19H21NO — CID 171244179

IUPAC(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine
SMILESN[C@H](c1ccc2c(c1)Cc1ccccc1-2)C1CCOCC1
InChIInChI=1S/C19H21NO/c20-19(13-7-9-21-10-8-13)15-5-6-18-16(12-15)11-14-3-1-2-4-17(14)18/h1-6,12-13,19H,7-11,20H2/t19-/m0/s1
InChIKeyQCPWCMZDRDXYGY-IBGZPJMESA-N
MW279.38 g/mol
LogP3.68
Rot. Bonds2

About (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine

(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine (PubChem CID 171244179) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine.

Molecular Properties

Compound Name(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine
PubChem CID171244179
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine
SMILESN[C@H](c1ccc2c(c1)Cc1ccccc1-2)C1CCOCC1
InChIInChI=1S/C19H21NO/c20-19(13-7-9-21-10-8-13)15-5-6-18-16(12-15)11-14-3-1-2-4-17(14)18/h1-6,12-13,19H,7-11,20H2/t19-/m0/s1
InChIKeyQCPWCMZDRDXYGY-IBGZPJMESA-N
XLogP3.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-cyclopropyl(9H-fluoren-2-yl)methanamine;hydrochloride
CID 171213662
(S)-cyclobutyl(9H-fluoren-2-yl)methanamine;hydrochloride
CID 171233283
(R)-naphthalen-2-yl(oxan-4-yl)methanamine
CID 171246771
(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride
CID 171246772
(S)-(3,4-diphenoxyphenyl)-(oxan-4-yl)methanamine
CID 171238967
(3,4-dichlorophenyl)-(oxan-4-yl)methanamine
CID 62906187
(S)-(3,4-dimethylphenyl)-(oxan-4-yl)methanamine
CID 94891825
(S)-(3-fluorophenyl)-(oxan-4-yl)methanamine
CID 95255362
(R)-(3-iodophenyl)-(oxan-4-yl)methanamine
CID 131503127
(S)-(3-chlorophenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171239392
(3-bromophenyl)-(oxan-4-yl)methanamine
CID 63934860
(1S,2R)-1-amino-1-(9H-fluoren-2-yl)propan-2-ol
CID 171270727

Frequently Asked Questions

What is the IUPAC name of (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine?
The IUPAC name of (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine (CID 171244179) is (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine.
What is the SMILES notation for (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine?
The canonical SMILES for (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine is N[C@H](c1ccc2c(c1)Cc1ccccc1-2)C1CCOCC1.
What is the InChIKey of (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine?
The InChIKey is QCPWCMZDRDXYGY-IBGZPJMESA-N. The full InChI is InChI=1S/C19H21NO/c20-19(13-7-9-21-10-8-13)15-5-6-18-16(12-15)11-14-3-1-2-4-17(14)18/h1-6,12-13,19H,7-11,20H2/t19-/m0/s1.
What are the key properties of (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine?
(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine has a molecular weight of 279.38 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-9H-fluoren-2-yl(oxan-4-yl)methanamine is sourced from PubChem (CID 171244179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).