1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine

C11H20FN — CID 105441799

IUPAC1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine
SMILESNC1(CCC2CCCC(F)C2)CC1
InChIInChI=1S/C11H20FN/c12-10-3-1-2-9(8-10)4-5-11(13)6-7-11/h9-10H,1-8,13H2
InChIKeyNLDBPUNBXOHEJH-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.79
Rot. Bonds3

About 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine

1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine (PubChem CID 105441799) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine
PubChem CID105441799
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine
SMILESNC1(CCC2CCCC(F)C2)CC1
InChIInChI=1S/C11H20FN/c12-10-3-1-2-9(8-10)4-5-11(13)6-7-11/h9-10H,1-8,13H2
InChIKeyNLDBPUNBXOHEJH-UHFFFAOYSA-N
XLogP2.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-fluorocyclohexyl)butan-2-amine
CID 84732026
1-[2-(thian-4-yl)ethyl]cyclopropan-1-amine
CID 83906962
1-[2-(3,3-difluorocyclopentyl)ethyl]cyclopropan-1-amine
CID 105443651
1-[2-[4-(difluoromethyl)cyclohexyl]ethyl]cyclopropan-1-amine
CID 105471508
1-[2-(thian-3-yl)ethyl]cyclopentan-1-amine
CID 115074209
1-(2-pyrrolidin-3-ylethyl)cyclohexan-1-amine
CID 115074244
1-(cycloheptylmethyl)cyclopropan-1-amine
CID 83682636
1-[2-(1,1-dioxothian-3-yl)ethyl]cyclopentan-1-amine
CID 115074208
trans-(1S,3S)-3-fluorocyclohexan-1-amine
CID 86333917
cis-(1R,3S)-3-fluorocyclohexan-1-amine
CID 86333919
1-[2-(1,2,6-trimethylpiperidin-4-yl)ethyl]cyclopropan-1-amine
CID 83909582
1-[2-(1,1-dioxothian-4-yl)ethyl]cyclopentan-1-amine
CID 115074188

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine (CID 105441799) is 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine is NC1(CCC2CCCC(F)C2)CC1.
What is the InChIKey of 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine?
The InChIKey is NLDBPUNBXOHEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c12-10-3-1-2-9(8-10)4-5-11(13)6-7-11/h9-10H,1-8,13H2.
What are the key properties of 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine?
1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine has a molecular weight of 185.29 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-fluorocyclohexyl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105441799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).