2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine

C15H30FN — CID 123748191

IUPAC2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine
SMILESCCC1(C)CC1(CC(C)CCCC(C)F)NC
InChIInChI=1S/C15H30FN/c1-6-14(4)11-15(14,17-5)10-12(2)8-7-9-13(3)16/h12-13,17H,6-11H2,1-5H3
InChIKeyNFNGDEGXTKOKRH-UHFFFAOYSA-N
MW243.41 g/mol
LogP4.32
Rot. Bonds8

About 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine

2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine (PubChem CID 123748191) has the molecular formula C15H30FN and a molecular weight of 243.41 g/mol. Its IUPAC name is 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine
PubChem CID123748191
Molecular FormulaC15H30FN
Molecular Weight243.41 g/mol
Exact Mass243.24
IUPAC Name2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine
SMILESCCC1(C)CC1(CC(C)CCCC(C)F)NC
InChIInChI=1S/C15H30FN/c1-6-14(4)11-15(14,17-5)10-12(2)8-7-9-13(3)16/h12-13,17H,6-11H2,1-5H3
InChIKeyNFNGDEGXTKOKRH-UHFFFAOYSA-N
XLogP4.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.41
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-(18F)fluoro-6-methylheptane
CID 153412043
4-fluoro-N-methylpentan-1-amine
CID 123463233
4-fluoropentane-1-thiol
CID 87282782
2-fluorohenicosane
CID 91354486
2,6-difluorooctadecane
CID 174393944
1-(2,6-dimethylheptan-2-yl)-2-ethyl-1,2-dimethylcyclopropane
CID 123993522
1,2-dimethyl-1-(6-methyloctan-2-yl)-2-propylcyclopropane
CID 123990318
1-ethyl-1,2,2-trimethylcyclopropane
CID 13115325
(3R,7R)-3,7-dimethylnonane
CID 42626759
5,9-dimethyldecan-3-ol
CID 545842
(3R)-3-fluoro-N-methylbutan-1-amine
CID 126693109
3-fluoro-3-(2-methylhexyl)azetidine
CID 155094729

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine?
The IUPAC name of 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine (CID 123748191) is 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine.
What is the SMILES notation for 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine?
The canonical SMILES for 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine is CCC1(C)CC1(CC(C)CCCC(C)F)NC.
What is the InChIKey of 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine?
The InChIKey is NFNGDEGXTKOKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30FN/c1-6-14(4)11-15(14,17-5)10-12(2)8-7-9-13(3)16/h12-13,17H,6-11H2,1-5H3.
What are the key properties of 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine?
2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine has a molecular weight of 243.41 g/mol, XLogP of 4.32, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(6-fluoro-2-methylheptyl)-N,2-dimethylcyclopropan-1-amine is sourced from PubChem (CID 123748191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).