2-amino-5-(2-fluoroethyl)cyclohexan-1-ol

C8H16FNO — CID 143177892

IUPAC2-amino-5-(2-fluoroethyl)cyclohexan-1-ol
SMILESNC1CCC(CCF)CC1O
InChIInChI=1S/C8H16FNO/c9-4-3-6-1-2-7(10)8(11)5-6/h6-8,11H,1-5,10H2
InChIKeyCCZNTBBWNFAVIS-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.83
Rot. Bonds2

About 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol

2-amino-5-(2-fluoroethyl)cyclohexan-1-ol (PubChem CID 143177892) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-amino-5-(2-fluoroethyl)cyclohexan-1-ol
PubChem CID143177892
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name2-amino-5-(2-fluoroethyl)cyclohexan-1-ol
SMILESNC1CCC(CCF)CC1O
InChIInChI=1S/C8H16FNO/c9-4-3-6-1-2-7(10)8(11)5-6/h6-8,11H,1-5,10H2
InChIKeyCCZNTBBWNFAVIS-UHFFFAOYSA-N
XLogP0.83
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol?
The IUPAC name of 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol (CID 143177892) is 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol.
What is the SMILES notation for 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol?
The canonical SMILES for 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol is NC1CCC(CCF)CC1O.
What is the InChIKey of 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol?
The InChIKey is CCZNTBBWNFAVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c9-4-3-6-1-2-7(10)8(11)5-6/h6-8,11H,1-5,10H2.
What are the key properties of 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol?
2-amino-5-(2-fluoroethyl)cyclohexan-1-ol has a molecular weight of 161.22 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-fluoroethyl)cyclohexan-1-ol is sourced from PubChem (CID 143177892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).