[1-(2-fluoroethylamino)cyclohexyl]methanol

C9H18FNO — CID 80694044

IUPAC[1-(2-fluoroethylamino)cyclohexyl]methanol
SMILESOCC1(NCCF)CCCCC1
InChIInChI=1S/C9H18FNO/c10-6-7-11-9(8-12)4-2-1-3-5-9/h11-12H,1-8H2
InChIKeyPUOIIYBOMSVEHB-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.24
Rot. Bonds4

About [1-(2-fluoroethylamino)cyclohexyl]methanol

[1-(2-fluoroethylamino)cyclohexyl]methanol (PubChem CID 80694044) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is [1-(2-fluoroethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(2-fluoroethylamino)cyclohexyl]methanol
PubChem CID80694044
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name[1-(2-fluoroethylamino)cyclohexyl]methanol
SMILESOCC1(NCCF)CCCCC1
InChIInChI=1S/C9H18FNO/c10-6-7-11-9(8-12)4-2-1-3-5-9/h11-12H,1-8H2
InChIKeyPUOIIYBOMSVEHB-UHFFFAOYSA-N
XLogP1.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(3-fluoropropylamino)cyclohexyl]methanol
CID 81106456
[1-(butylamino)cyclohexyl]methanol
CID 62520970
[1-(2-methylsulfanylethylamino)cyclohexyl]methanol
CID 115909619
[1-[2-(trifluoromethylsulfanyl)ethylamino]cyclohexyl]methanol
CID 116615536
[1-(2-ethoxyethylamino)cyclohexyl]methanol
CID 62521886
[1-(hexylamino)cyclohexyl]methanol
CID 62519893
[1-(3-methylbutylamino)cyclopentyl]methanol
CID 62523608
[1-[(3-methoxy-3-methylbutyl)amino]cyclohexyl]methanol
CID 102977850
[1-(hept-6-enylamino)cyclohexyl]methanol
CID 107006791
[1-(3,3-diethoxypropylamino)cyclohexyl]methanol
CID 81092728
3-[[1-(hydroxymethyl)cyclohexyl]amino]-N-propan-2-ylpropanamide
CID 62625547
(2S)-1-[[1-(hydroxymethyl)cyclohexyl]amino]propan-2-ol
CID 94468479

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoroethylamino)cyclohexyl]methanol?
The IUPAC name of [1-(2-fluoroethylamino)cyclohexyl]methanol (CID 80694044) is [1-(2-fluoroethylamino)cyclohexyl]methanol.
What is the SMILES notation for [1-(2-fluoroethylamino)cyclohexyl]methanol?
The canonical SMILES for [1-(2-fluoroethylamino)cyclohexyl]methanol is OCC1(NCCF)CCCCC1.
What is the InChIKey of [1-(2-fluoroethylamino)cyclohexyl]methanol?
The InChIKey is PUOIIYBOMSVEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c10-6-7-11-9(8-12)4-2-1-3-5-9/h11-12H,1-8H2.
What are the key properties of [1-(2-fluoroethylamino)cyclohexyl]methanol?
[1-(2-fluoroethylamino)cyclohexyl]methanol has a molecular weight of 175.25 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoroethylamino)cyclohexyl]methanol is sourced from PubChem (CID 80694044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).