3-fluorocyclohexan-1-amine;hydrochloride

C6H13ClFN — CID 84716542

IUPAC3-fluorocyclohexan-1-amine;hydrochloride
SMILESCl.NC1CCCC(F)C1
InChIInChI=1S/C6H12FN.ClH/c7-5-2-1-3-6(8)4-5;/h5-6H,1-4,8H2;1H
InChIKeyQKCMJPLQBZUZRS-UHFFFAOYSA-N
MW153.63 g/mol
LogP1.65
Rot. Bonds

About 3-fluorocyclohexan-1-amine;hydrochloride

3-fluorocyclohexan-1-amine;hydrochloride (PubChem CID 84716542) has the molecular formula C6H13ClFN and a molecular weight of 153.63 g/mol. Its IUPAC name is 3-fluorocyclohexan-1-amine;hydrochloride.

Molecular Properties

Compound Name3-fluorocyclohexan-1-amine;hydrochloride
PubChem CID84716542
Molecular FormulaC6H13ClFN
Molecular Weight153.63 g/mol
Exact Mass153.07
IUPAC Name3-fluorocyclohexan-1-amine;hydrochloride
SMILESCl.NC1CCCC(F)C1
InChIInChI=1S/C6H12FN.ClH/c7-5-2-1-3-6(8)4-5;/h5-6H,1-4,8H2;1H
InChIKeyQKCMJPLQBZUZRS-UHFFFAOYSA-N
XLogP1.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.63
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclohexylamine
CID 7965
Cyclohexylamine hydrochloride
CID 2723770
Cyclohexylazanium;chloride
CID 21097
Cyclohexylammonium Ion
CID 1549093
Cyclohexylammonium bromide
CID 117303
4-Fluorocyclohexan-1-amine hydrochloride
CID 54772395
Cyclohexylamine Hydroiodide
CID 129649132
(4,4-Difluorocyclohexyl)amine
CID 3847030
Cyclohexanamine, N-chloro-
CID 104113
4,4-Difluorocyclohexan-1-amine hydrochloride
CID 23150669
2,2-Difluorocyclohexan-1-amine hydrochloride
CID 66791418
3,3-Difluorocyclohexan-1-amine hydrochloride
CID 71711147

Frequently Asked Questions

What is the IUPAC name of 3-fluorocyclohexan-1-amine;hydrochloride?
The IUPAC name of 3-fluorocyclohexan-1-amine;hydrochloride (CID 84716542) is 3-fluorocyclohexan-1-amine;hydrochloride.
What is the SMILES notation for 3-fluorocyclohexan-1-amine;hydrochloride?
The canonical SMILES for 3-fluorocyclohexan-1-amine;hydrochloride is Cl.NC1CCCC(F)C1.
What is the InChIKey of 3-fluorocyclohexan-1-amine;hydrochloride?
The InChIKey is QKCMJPLQBZUZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN.ClH/c7-5-2-1-3-6(8)4-5;/h5-6H,1-4,8H2;1H.
What are the key properties of 3-fluorocyclohexan-1-amine;hydrochloride?
3-fluorocyclohexan-1-amine;hydrochloride has a molecular weight of 153.63 g/mol, XLogP of 1.65, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluorocyclohexan-1-amine;hydrochloride is sourced from PubChem (CID 84716542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).