4-(2-fluorophenoxy)cyclohexan-1-amine

C12H16FNO — CID 62807605

IUPAC4-(2-fluorophenoxy)cyclohexan-1-amine
SMILESNC1CCC(Oc2ccccc2F)CC1
InChIInChI=1S/C12H16FNO/c13-11-3-1-2-4-12(11)15-10-7-5-9(14)6-8-10/h1-4,9-10H,5-8,14H2
InChIKeyKWBGOSSLOYVPGP-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.47
Rot. Bonds2

About 4-(2-fluorophenoxy)cyclohexan-1-amine

4-(2-fluorophenoxy)cyclohexan-1-amine (PubChem CID 62807605) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 4-(2-fluorophenoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(2-fluorophenoxy)cyclohexan-1-amine
PubChem CID62807605
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name4-(2-fluorophenoxy)cyclohexan-1-amine
SMILESNC1CCC(Oc2ccccc2F)CC1
InChIInChI=1S/C12H16FNO/c13-11-3-1-2-4-12(11)15-10-7-5-9(14)6-8-10/h1-4,9-10H,5-8,14H2
InChIKeyKWBGOSSLOYVPGP-UHFFFAOYSA-N
XLogP2.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Phenoxyethanamine
CID 15651
1-Phenoxy-2-propanamine
CID 37087
(3-Phenoxypropyl)amine
CID 418237
3-(4-Fluorophenoxy)propan-1-amine
CID 14025825
(E)-3-fluoro-4-phenoxybut-2-en-1-amine
CID 42624010
(E)-4-(3,4-difluorophenoxy)-3-fluorobut-2-en-1-amine
CID 42624093
(E)-3-fluoro-4-(4-phenoxyphenoxy)but-2-en-1-amine
CID 42624190
4-(4-Fluorophenoxy)butan-1-amine
CID 7131478
4-Phenoxybutan-1-amine
CID 116240
N-tert-butyl-4-(2-fluorophenoxy)-1-butanamine
CID 2247152
1-[4-(2-Fluorophenoxy)butyl]piperidine
CID 2058901
4-[(3-Fluorophenoxy)methyl]piperidine
CID 17178045

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenoxy)cyclohexan-1-amine?
The IUPAC name of 4-(2-fluorophenoxy)cyclohexan-1-amine (CID 62807605) is 4-(2-fluorophenoxy)cyclohexan-1-amine.
What is the SMILES notation for 4-(2-fluorophenoxy)cyclohexan-1-amine?
The canonical SMILES for 4-(2-fluorophenoxy)cyclohexan-1-amine is NC1CCC(Oc2ccccc2F)CC1.
What is the InChIKey of 4-(2-fluorophenoxy)cyclohexan-1-amine?
The InChIKey is KWBGOSSLOYVPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-11-3-1-2-4-12(11)15-10-7-5-9(14)6-8-10/h1-4,9-10H,5-8,14H2.
What are the key properties of 4-(2-fluorophenoxy)cyclohexan-1-amine?
4-(2-fluorophenoxy)cyclohexan-1-amine has a molecular weight of 209.26 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenoxy)cyclohexan-1-amine is sourced from PubChem (CID 62807605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).