[4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine

C10H17F4N — CID 84735882

IUPAC[4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine
SMILESNCC1CCC(CC(F)C(F)(F)F)CC1
InChIInChI=1S/C10H17F4N/c11-9(10(12,13)14)5-7-1-3-8(6-15)4-2-7/h7-9H,1-6,15H2
InChIKeyATRXRMNYKCHTSS-UHFFFAOYSA-N
MW227.24 g/mol
LogP3.04
Rot. Bonds3

About [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine

[4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine (PubChem CID 84735882) has the molecular formula C10H17F4N and a molecular weight of 227.24 g/mol. Its IUPAC name is [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine
PubChem CID84735882
Molecular FormulaC10H17F4N
Molecular Weight227.24 g/mol
Exact Mass227.13
IUPAC Name[4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine
SMILESNCC1CCC(CC(F)C(F)(F)F)CC1
InChIInChI=1S/C10H17F4N/c11-9(10(12,13)14)5-7-1-3-8(6-15)4-2-7/h7-9H,1-6,15H2
InChIKeyATRXRMNYKCHTSS-UHFFFAOYSA-N
XLogP3.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[4-(1-fluoroethyl)cyclohexyl]methanamine
CID 84764155
[4-(aminomethyl)cyclohexyl]methanamine
CID 158172497
[1-(2,3,3,3-tetrafluoropropyl)pyrrolidin-3-yl]methanamine
CID 115028625
[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane
CID 87736977
1-[4-(1,2,2,2-tetrafluoroethyl)cyclohexyl]propan-2-amine
CID 84737021
1-[4-(aminomethyl)cyclohexyl]propan-2-ol
CID 70069622
3-fluoro-2-methyl-4-(4-methylcyclohexyl)butan-2-amine
CID 126984889
[4-(2-methylbutyl)cyclohexyl]methanamine
CID 130208059
2-[4-(1,2,2,2-tetrafluoroethyl)cyclohexyl]acetaldehyde
CID 84735787
1-(bromomethyl)-4-(1,2,2,2-tetrafluoroethyl)cyclohexane
CID 84738909
3-cyclopropyl-2,2,3-trifluoropropan-1-amine
CID 105429846
(3-propan-2-ylcyclopentyl)methanamine
CID 55290681

Frequently Asked Questions

What is the IUPAC name of [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine?
The IUPAC name of [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine (CID 84735882) is [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine.
What is the SMILES notation for [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine?
The canonical SMILES for [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine is NCC1CCC(CC(F)C(F)(F)F)CC1.
What is the InChIKey of [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine?
The InChIKey is ATRXRMNYKCHTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F4N/c11-9(10(12,13)14)5-7-1-3-8(6-15)4-2-7/h7-9H,1-6,15H2.
What are the key properties of [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine?
[4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine has a molecular weight of 227.24 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3,3,3-tetrafluoropropyl)cyclohexyl]methanamine is sourced from PubChem (CID 84735882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).