2-(1-fluorocyclohexyl)-N-methylethanamine

C9H18FN — CID 84731476

IUPAC2-(1-fluorocyclohexyl)-N-methylethanamine
SMILESCNCCC1(F)CCCCC1
InChIInChI=1S/C9H18FN/c1-11-8-7-9(10)5-3-2-4-6-9/h11H,2-8H2,1H3
InChIKeyZHVRGHYPJVFEKY-UHFFFAOYSA-N
MW159.25 g/mol
LogP2.27
Rot. Bonds3

About 2-(1-fluorocyclohexyl)-N-methylethanamine

2-(1-fluorocyclohexyl)-N-methylethanamine (PubChem CID 84731476) has the molecular formula C9H18FN and a molecular weight of 159.25 g/mol. Its IUPAC name is 2-(1-fluorocyclohexyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(1-fluorocyclohexyl)-N-methylethanamine
PubChem CID84731476
Molecular FormulaC9H18FN
Molecular Weight159.25 g/mol
Exact Mass159.14
IUPAC Name2-(1-fluorocyclohexyl)-N-methylethanamine
SMILESCNCCC1(F)CCCCC1
InChIInChI=1S/C9H18FN/c1-11-8-7-9(10)5-3-2-4-6-9/h11H,2-8H2,1H3
InChIKeyZHVRGHYPJVFEKY-UHFFFAOYSA-N
XLogP2.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.25
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-[(1-fluorocyclopentyl)methyl]phenyl]-N-methylethanamine
CID 84727142
3-(1-fluorocyclohexyl)propanenitrile
CID 84763610
2-(1-fluorocyclobutyl)ethylurea
CID 130694117
1-(1-fluorocyclopropyl)-N-methylmethanamine
CID 84647620
ethane;2-(3-ethylpyrrolidin-3-yl)-N-methylethanamine
CID 143462559
1-[2-(methylamino)ethyl]cyclopropane-1-carbaldehyde
CID 144732872
N,N'-dimethylethane-1,2-diamine;ethane
CID 90689080
1-(3-fluorothian-3-yl)-N-methylmethanamine
CID 84731546
N-[(1-fluorocyclohexyl)methyl]-2-methylpropan-1-amine
CID 126847938
N-methyl-2-[1-[2-(4-propylphenyl)ethyl]cyclohexyl]ethanamine
CID 65303003
2-[1-[2-(4-fluorophenyl)ethyl]cyclopentyl]-N-methylethanamine
CID 65304957
[1-(1-fluorocyclohexyl)-3-(methylamino)propan-2-yl]carbamic acid
CID 68713570

Frequently Asked Questions

What is the IUPAC name of 2-(1-fluorocyclohexyl)-N-methylethanamine?
The IUPAC name of 2-(1-fluorocyclohexyl)-N-methylethanamine (CID 84731476) is 2-(1-fluorocyclohexyl)-N-methylethanamine.
What is the SMILES notation for 2-(1-fluorocyclohexyl)-N-methylethanamine?
The canonical SMILES for 2-(1-fluorocyclohexyl)-N-methylethanamine is CNCCC1(F)CCCCC1.
What is the InChIKey of 2-(1-fluorocyclohexyl)-N-methylethanamine?
The InChIKey is ZHVRGHYPJVFEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FN/c1-11-8-7-9(10)5-3-2-4-6-9/h11H,2-8H2,1H3.
What are the key properties of 2-(1-fluorocyclohexyl)-N-methylethanamine?
2-(1-fluorocyclohexyl)-N-methylethanamine has a molecular weight of 159.25 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluorocyclohexyl)-N-methylethanamine is sourced from PubChem (CID 84731476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).