(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine

C14H20FNO — CID 93023442

IUPAC(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine
SMILESCOc1ccc(F)cc1[C@H](N)C1CCCCC1
InChIInChI=1S/C14H20FNO/c1-17-13-8-7-11(15)9-12(13)14(16)10-5-3-2-4-6-10/h7-10,14H,2-6,16H2,1H3/t14-/m1/s1
InChIKeyDXWZBDCQDUKAFK-CQSZACIVSA-N
MW237.32 g/mol
LogP3.41
Rot. Bonds3

About (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine

(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine (PubChem CID 93023442) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine.

Molecular Properties

Compound Name(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine
PubChem CID93023442
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine
SMILESCOc1ccc(F)cc1[C@H](N)C1CCCCC1
InChIInChI=1S/C14H20FNO/c1-17-13-8-7-11(15)9-12(13)14(16)10-5-3-2-4-6-10/h7-10,14H,2-6,16H2,1H3/t14-/m1/s1
InChIKeyDXWZBDCQDUKAFK-CQSZACIVSA-N
XLogP3.41
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-fluoro-2-methoxyphenyl)-(3-methylcyclohexyl)methanamine
CID 82769188
4-[amino-(5-fluoro-2-methoxyphenyl)methyl]cyclohexan-1-one
CID 116941932
(5-chloro-2-methoxyphenyl)-cycloheptylmethanamine
CID 65399712
(1R,2S)-2-amino-1-cyclohexyl-2-(5-fluoro-2-methoxyphenyl)ethanol;hydrochloride
CID 171268203
(R)-cyclohexyl-(2,5-dimethoxyphenyl)methanamine;hydrochloride
CID 171200242
(3-ethylcyclohexyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 82770138
(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
CID 107177071
(5-fluoro-2-methoxyphenyl)-(1-methylpyrrolidin-3-yl)methanamine
CID 83824626
(R)-cyclopentyl-(2-methoxyphenyl)methanamine;hydrochloride
CID 171200457
2-cyclopropyl-1-(5-fluoro-2-methoxyphenyl)propan-1-amine
CID 83154876
2-[(S)-amino(cyclohexyl)methyl]-4-fluoro-6-methoxyphenol;hydrochloride
CID 171256025
(S)-cyclopropyl-(4-fluoro-2-methoxyphenyl)methanamine;hydrochloride
CID 171224902

Frequently Asked Questions

What is the IUPAC name of (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine?
The IUPAC name of (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine (CID 93023442) is (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine.
What is the SMILES notation for (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine?
The canonical SMILES for (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine is COc1ccc(F)cc1[C@H](N)C1CCCCC1.
What is the InChIKey of (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine?
The InChIKey is DXWZBDCQDUKAFK-CQSZACIVSA-N. The full InChI is InChI=1S/C14H20FNO/c1-17-13-8-7-11(15)9-12(13)14(16)10-5-3-2-4-6-10/h7-10,14H,2-6,16H2,1H3/t14-/m1/s1.
What are the key properties of (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine?
(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine has a molecular weight of 237.32 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine is sourced from PubChem (CID 93023442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).