3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol

C13H18FNO — CID 103270976

IUPAC3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNCc2ccccc2F)C1
InChIInChI=1S/C13H18FNO/c14-13-4-2-1-3-11(13)9-15-8-10-5-6-12(16)7-10/h1-4,10,12,15-16H,5-9H2
InChIKeyXLNYYCDYWQOKMH-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.08
Rot. Bonds4

About 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol

3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 103270976) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
PubChem CID103270976
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNCc2ccccc2F)C1
InChIInChI=1S/C13H18FNO/c14-13-4-2-1-3-11(13)9-15-8-10-5-6-12(16)7-10/h1-4,10,12,15-16H,5-9H2
InChIKeyXLNYYCDYWQOKMH-UHFFFAOYSA-N
XLogP2.08
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[(2-chloro-3-fluorophenyl)methylamino]methyl]cyclohexan-1-ol
CID 114147754
3-[[(2,3-difluorophenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699998
3-[[[2-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
CID 114146215
3-[[(2,3-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270925
3-[[(2-fluoro-3-methoxyphenyl)methylamino]methyl]cyclopentan-1-ol
CID 106129789
3-[[(2,3-dichlorophenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270651
3-[[(2-fluoro-3-nitrophenyl)methylamino]methyl]cyclopentan-1-ol
CID 106129534
3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270748
N-[(2-fluorophenyl)methyl]-1-pyrrolidin-3-ylmethanamine
CID 115208851
1-cyclopropyl-N-[(2,3-difluorophenyl)methyl]methanamine
CID 43658793
3-[[(2-fluoro-5-methylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 113243257
4-chloro-2-[[(3-hydroxycyclopentyl)methylamino]methyl]phenol
CID 103270835

Frequently Asked Questions

What is the IUPAC name of 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol (CID 103270976) is 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol is OC1CCC(CNCc2ccccc2F)C1.
What is the InChIKey of 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is XLNYYCDYWQOKMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c14-13-4-2-1-3-11(13)9-15-8-10-5-6-12(16)7-10/h1-4,10,12,15-16H,5-9H2.
What are the key properties of 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 223.29 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103270976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).