5-fluoro-N,2,4,6-tetramethyloxan-3-amine

C9H18FNO — CID 59938453

IUPAC5-fluoro-N,2,4,6-tetramethyloxan-3-amine
SMILESCNC1C(C)OC(C)C(F)C1C
InChIInChI=1S/C9H18FNO/c1-5-8(10)6(2)12-7(3)9(5)11-4/h5-9,11H,1-4H3
InChIKeyCYLOXHGBOBOABN-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.36
Rot. Bonds1

About 5-fluoro-N,2,4,6-tetramethyloxan-3-amine

5-fluoro-N,2,4,6-tetramethyloxan-3-amine (PubChem CID 59938453) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 5-fluoro-N,2,4,6-tetramethyloxan-3-amine.

Molecular Properties

Compound Name5-fluoro-N,2,4,6-tetramethyloxan-3-amine
PubChem CID59938453
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name5-fluoro-N,2,4,6-tetramethyloxan-3-amine
SMILESCNC1C(C)OC(C)C(F)C1C
InChIInChI=1S/C9H18FNO/c1-5-8(10)6(2)12-7(3)9(5)11-4/h5-9,11H,1-4H3
InChIKeyCYLOXHGBOBOABN-UHFFFAOYSA-N
XLogP1.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Fluoro-2,4,6-trimethyloxan-3-amine
CID 59938457
1-[(2S,5R,6R)-5-fluoro-6-methyloxan-2-yl]-N-methylmethanamine
CID 60076853
(2S,5R)-2-(cyclopropylmethyl)-5-(fluoromethyl)morpholine
CID 90065255
6-Ethyl-5-(fluoromethyl)piperidin-3-ol
CID 126716122
N-[(4,4-difluorocyclohexyl)methyl]oxan-3-amine
CID 128268753
2,5-Dimethyl-6-(trifluoromethyl)oxan-3-amine
CID 129076842
(3S,5R,6R)-6-ethyl-5-(fluoromethyl)piperidin-3-ol
CID 135264751
1-(3-Fluoro-4-methyloxan-2-yl)ethanamine
CID 142537579
(2-Ethyl-1-piperidin-2-ylpentyl) hypofluorite
CID 144738728
N-[(2R,3S,5S)-5-fluoro-6-(fluoromethyl)-2,4-dimethyloxan-3-yl]acetamide
CID 158829517
2-Tert-butyl-3-fluoro-5-methoxypiperidine
CID 164775357
N-[(3S,5S)-5-fluoro-6-(fluoromethyl)-2,4-dimethyloxan-3-yl]acetamide
CID 165005458

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N,2,4,6-tetramethyloxan-3-amine?
The IUPAC name of 5-fluoro-N,2,4,6-tetramethyloxan-3-amine (CID 59938453) is 5-fluoro-N,2,4,6-tetramethyloxan-3-amine.
What is the SMILES notation for 5-fluoro-N,2,4,6-tetramethyloxan-3-amine?
The canonical SMILES for 5-fluoro-N,2,4,6-tetramethyloxan-3-amine is CNC1C(C)OC(C)C(F)C1C.
What is the InChIKey of 5-fluoro-N,2,4,6-tetramethyloxan-3-amine?
The InChIKey is CYLOXHGBOBOABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c1-5-8(10)6(2)12-7(3)9(5)11-4/h5-9,11H,1-4H3.
What are the key properties of 5-fluoro-N,2,4,6-tetramethyloxan-3-amine?
5-fluoro-N,2,4,6-tetramethyloxan-3-amine has a molecular weight of 175.25 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N,2,4,6-tetramethyloxan-3-amine is sourced from PubChem (CID 59938453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).