N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine

C13H16F3N — CID 4264836

IUPACN-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine
SMILESFC(F)(F)c1ccc(CNC2CCCC2)cc1
InChIInChI=1S/C13H16F3N/c14-13(15,16)11-7-5-10(6-8-11)9-17-12-3-1-2-4-12/h5-8,12,17H,1-4,9H2
InChIKeyJOLZGZTYGULTQA-UHFFFAOYSA-N
MW243.27 g/mol
LogP3.74
Rot. Bonds3

About N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine

N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine (PubChem CID 4264836) has the molecular formula C13H16F3N and a molecular weight of 243.27 g/mol. Its IUPAC name is N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine
PubChem CID4264836
Molecular FormulaC13H16F3N
Molecular Weight243.27 g/mol
Exact Mass243.12
IUPAC NameN-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine
SMILESFC(F)(F)c1ccc(CNC2CCCC2)cc1
InChIInChI=1S/C13H16F3N/c14-13(15,16)11-7-5-10(6-8-11)9-17-12-3-1-2-4-12/h5-8,12,17H,1-4,9H2
InChIKeyJOLZGZTYGULTQA-UHFFFAOYSA-N
XLogP3.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[4-(trifluoromethyl)phenyl]methyl]thian-4-amine
CID 60699978
N-[[4-(trifluoromethyl)phenyl]methyl]thian-3-amine
CID 62880283
N-[(4-tert-butylphenyl)methyl]cycloheptanamine
CID 28509997
N-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-amine
CID 79740953
3-N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentane-1,3-diamine
CID 79461380
1-prop-2-ynyl-N-[[4-(trifluoromethyl)phenyl]methyl]piperidin-4-amine
CID 62881993
4-[(cyclopentylamino)methyl]phenol
CID 3873791
2-[[4-(trifluoromethyl)phenyl]methylamino]cyclohexane-1-carbonitrile
CID 62879600
N-[2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanamine
CID 62114541
N-[(4-bromophenyl)methyl]cyclopentanamine;hydrochloride
CID 17289669
N-(pyridin-4-ylmethyl)cyclooctanamine
CID 4722994
1-[(3S)-3-[[4-(trifluoromethyl)phenyl]methylamino]piperidin-1-yl]prop-2-en-1-one
CID 155353379

Frequently Asked Questions

What is the IUPAC name of N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine?
The IUPAC name of N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine (CID 4264836) is N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine.
What is the SMILES notation for N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine?
The canonical SMILES for N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine is FC(F)(F)c1ccc(CNC2CCCC2)cc1.
What is the InChIKey of N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine?
The InChIKey is JOLZGZTYGULTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F3N/c14-13(15,16)11-7-5-10(6-8-11)9-17-12-3-1-2-4-12/h5-8,12,17H,1-4,9H2.
What are the key properties of N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine?
N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine has a molecular weight of 243.27 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(trifluoromethyl)phenyl]methyl]cyclopentanamine is sourced from PubChem (CID 4264836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).