3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol

C13H18FNO — CID 103270748

IUPAC3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNCc2ccc(F)cc2)C1
InChIInChI=1S/C13H18FNO/c14-12-4-1-10(2-5-12)8-15-9-11-3-6-13(16)7-11/h1-2,4-5,11,13,15-16H,3,6-9H2
InChIKeySZBDRCWHDUHFBS-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.08
Rot. Bonds4

About 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol

3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 103270748) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
PubChem CID103270748
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNCc2ccc(F)cc2)C1
InChIInChI=1S/C13H18FNO/c14-12-4-1-10(2-5-12)8-15-9-11-3-6-13(16)7-11/h1-2,4-5,11,13,15-16H,3,6-9H2
InChIKeySZBDRCWHDUHFBS-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

4-[[(4-fluorophenyl)methylamino]methyl]cyclohexan-1-amine
CID 115213417
3-[[[4-(trifluoromethylsulfanyl)phenyl]methylamino]methyl]cyclopentan-1-ol
CID 103270930
3-[[(4-iodophenyl)methylamino]methyl]cyclohexan-1-ol
CID 106132031
3-[[(2-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270976
3-[[(4-chlorophenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699808
4-[[(4-fluorophenyl)methylamino]methyl]cyclohexane-1-carboxylic acid
CID 5005578
3-[[(4-methylsulfanylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699915
3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270774
3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270659
3-[[(3-bromo-4-fluorophenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699874
3-[[(6-methoxynaphthalen-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 103270839
3-[[[4-(methoxymethyl)phenyl]methylamino]methyl]cyclohexan-1-ol
CID 103699801

Frequently Asked Questions

What is the IUPAC name of 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol (CID 103270748) is 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol is OC1CCC(CNCc2ccc(F)cc2)C1.
What is the InChIKey of 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is SZBDRCWHDUHFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c14-12-4-1-10(2-5-12)8-15-9-11-3-6-13(16)7-11/h1-2,4-5,11,13,15-16H,3,6-9H2.
What are the key properties of 3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol?
3-[[(4-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-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103270748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).