[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol

C12H16FNO — CID 117298948

IUPAC[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol
SMILESNC1(c2cc(CO)ccc2F)CCCC1
InChIInChI=1S/C12H16FNO/c13-11-4-3-9(8-15)7-10(11)12(14)5-1-2-6-12/h3-4,7,15H,1-2,5-6,8,14H2
InChIKeyCFZJQHPRXANCIK-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.05
Rot. Bonds2

About [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol

[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol (PubChem CID 117298948) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol.

Molecular Properties

Compound Name[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol
PubChem CID117298948
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol
SMILESNC1(c2cc(CO)ccc2F)CCCC1
InChIInChI=1S/C12H16FNO/c13-11-4-3-9(8-15)7-10(11)12(14)5-1-2-6-12/h3-4,7,15H,1-2,5-6,8,14H2
InChIKeyCFZJQHPRXANCIK-UHFFFAOYSA-N
XLogP2.05
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-difluorophenyl)cyclopentan-1-amine
CID 62802401
1-[2-fluoro-5-(hydroxymethyl)phenyl]cyclopentane-1-carboxylic acid
CID 117348913
1-(2-fluoro-5-methylphenyl)cyclopentan-1-amine
CID 62788352
3-(1-aminocyclopentyl)-6-fluorobenzene-1,2-diol
CID 117301232
(3,4-difluorophenyl)methanol
CID 522833
3-(1-aminocyclohexyl)-6-fluorobenzene-1,2-diol
CID 117323320
1-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)cyclohexan-1-amine
CID 117371666
1-(2,4-difluorophenyl)cyclohexan-1-amine
CID 62802198
1-(5-bromo-2,4-difluorophenyl)cyclopentan-1-amine
CID 84810883
4-(2-fluoro-5-methylphenyl)oxepan-4-amine
CID 65077062
1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine
CID 117310158
4-(1-aminocyclohexyl)-2-bromo-5-fluorophenol
CID 84814370

Frequently Asked Questions

What is the IUPAC name of [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol?
The IUPAC name of [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol (CID 117298948) is [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol.
What is the SMILES notation for [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol?
The canonical SMILES for [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol is NC1(c2cc(CO)ccc2F)CCCC1.
What is the InChIKey of [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol?
The InChIKey is CFZJQHPRXANCIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-11-4-3-9(8-15)7-10(11)12(14)5-1-2-6-12/h3-4,7,15H,1-2,5-6,8,14H2.
What are the key properties of [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol?
[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol has a molecular weight of 209.26 g/mol, XLogP of 2.05, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-aminocyclopentyl)-4-fluorophenyl]methanol is sourced from PubChem (CID 117298948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).