1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol

C14H18F3NO2 — CID 63932476

IUPAC1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol
SMILESOC1(CNCc2ccccc2OC(F)(F)F)CCCC1
InChIInChI=1S/C14H18F3NO2/c15-14(16,17)20-12-6-2-1-5-11(12)9-18-10-13(19)7-3-4-8-13/h1-2,5-6,18-19H,3-4,7-10H2
InChIKeyUBFSPGGRMRJTRP-UHFFFAOYSA-N
MW289.30 g/mol
LogP2.98
Rot. Bonds5

About 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol

1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol (PubChem CID 63932476) has the molecular formula C14H18F3NO2 and a molecular weight of 289.30 g/mol. Its IUPAC name is 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol
PubChem CID63932476
Molecular FormulaC14H18F3NO2
Molecular Weight289.30 g/mol
Exact Mass289.13
IUPAC Name1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol
SMILESOC1(CNCc2ccccc2OC(F)(F)F)CCCC1
InChIInChI=1S/C14H18F3NO2/c15-14(16,17)20-12-6-2-1-5-11(12)9-18-10-13(19)7-3-4-8-13/h1-2,5-6,18-19H,3-4,7-10H2
InChIKeyUBFSPGGRMRJTRP-UHFFFAOYSA-N
XLogP2.98
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.30
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopropyl]methanol
CID 79479077
1-[2-(trifluoromethoxy)phenyl]-N-[[2-(trifluoromethoxy)phenyl]methyl]methanamine
CID 112803590
1-[[(2-bromophenyl)methylamino]methyl]cyclopentan-1-ol
CID 63931838
1-[[(2-fluoro-3-methoxyphenyl)methylamino]methyl]cyclohexan-1-ol
CID 104791869
N-[[2-(trifluoromethoxy)phenyl]methyl]hydroxylamine
CID 82684299
2-[2-[[(1-hydroxycyclohexyl)methylamino]methyl]phenoxy]-N-methylacetamide
CID 110922665
1-amino-N-[[2-(trifluoromethoxy)phenyl]methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119275621
1-[[2-(trifluoromethoxy)phenyl]methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 146134402
2-ethoxy-6-[[(1-hydroxycyclopentyl)methylamino]methyl]phenol
CID 63933499
1-[(1-hydroxycyclopentyl)methyl]-3-[[2-(2,2,2-trifluoroethoxy)phenyl]methyl]urea
CID 111104097
1-(2-methylphenyl)-N-[[2-(trifluoromethoxy)phenyl]methyl]methanamine
CID 60699442
2-bromo-6-[[(1-hydroxycyclopentyl)methylamino]methyl]phenol
CID 63934114

Frequently Asked Questions

What is the IUPAC name of 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol (CID 63932476) is 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol is OC1(CNCc2ccccc2OC(F)(F)F)CCCC1.
What is the InChIKey of 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol?
The InChIKey is UBFSPGGRMRJTRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3NO2/c15-14(16,17)20-12-6-2-1-5-11(12)9-18-10-13(19)7-3-4-8-13/h1-2,5-6,18-19H,3-4,7-10H2.
What are the key properties of 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol?
1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol has a molecular weight of 289.30 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[2-(trifluoromethoxy)phenyl]methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 63932476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).