(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine

C14H20FNO — CID 107177071

IUPAC(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
SMILESCOc1ccc(F)cc1C(N)C1CCCC1C
InChIInChI=1S/C14H20FNO/c1-9-4-3-5-11(9)14(16)12-8-10(15)6-7-13(12)17-2/h6-9,11,14H,3-5,16H2,1-2H3
InChIKeyZHOOFBGGIXFSQF-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.27
Rot. Bonds3

About (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine

(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine (PubChem CID 107177071) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine.

Molecular Properties

Compound Name(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
PubChem CID107177071
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
SMILESCOc1ccc(F)cc1C(N)C1CCCC1C
InChIInChI=1S/C14H20FNO/c1-9-4-3-5-11(9)14(16)12-8-10(15)6-7-13(12)17-2/h6-9,11,14H,3-5,16H2,1-2H3
InChIKeyZHOOFBGGIXFSQF-UHFFFAOYSA-N
XLogP3.27
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 ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-fluoro-2-methoxyphenyl)-(3-methylcyclohexyl)methanamine
CID 82769188
2-(5-fluoro-2-methoxyphenyl)-2-(2-methylcyclohexyl)ethanamine
CID 83974794
(R)-cyclohexyl-(5-fluoro-2-methoxyphenyl)methanamine
CID 93023442
(2-fluoro-4,5-dimethoxyphenyl)-(2-methylcyclopentyl)methanamine
CID 107177787
(2,4-difluorophenyl)-(2-methylcyclopentyl)methanamine
CID 107177000
amino-(5-fluoro-2-methoxyphenyl)methanethiol
CID 116939436
(5-bromo-4-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine
CID 107178298
(4-methoxynaphthalen-1-yl)-(2-methylcyclopentyl)methanamine
CID 107177081
(3-ethylcyclohexyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 82770138
4-[amino-(5-fluoro-2-methoxyphenyl)methyl]cyclohexan-1-one
CID 116941932
(2-fluorophenyl)-(2-methylcyclopentyl)methanamine
CID 107188100
[(5-fluoro-2-methoxyphenyl)-(2-methylcyclopropyl)methyl]hydrazine
CID 105234968

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine?
The IUPAC name of (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine (CID 107177071) is (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine.
What is the SMILES notation for (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine?
The canonical SMILES for (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine is COc1ccc(F)cc1C(N)C1CCCC1C.
What is the InChIKey of (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine?
The InChIKey is ZHOOFBGGIXFSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-9-4-3-5-11(9)14(16)12-8-10(15)6-7-13(12)17-2/h6-9,11,14H,3-5,16H2,1-2H3.
What are the key properties of (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine?
(5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine has a molecular weight of 237.32 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2-methoxyphenyl)-(2-methylcyclopentyl)methanamine is sourced from PubChem (CID 107177071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).